USER MOD reduce.3.24.130724 H: found=0, std=0, add=1188, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1177 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 122 CYS SG : rot 147:sc= 1.16 USER MOD Set 1.2: C 125 CYS SG : rot -152:sc= -0.914! USER MOD Set 1.3: C 144 CYS SG : rot 178:sc= -0.735! USER MOD Set 1.4: C 146 GLN :FLIP amide:sc= 1.67 F(o=-1!,f=1.2) USER MOD Set 2.1: C 113 LYS NZ :NH3+ 152:sc= 0.516 (180deg=0) USER MOD Set 2.2: C 115 TYR OH : rot 180:sc= 0.483 USER MOD Set 3.1: C 94 CYS SG : rot 117:sc= 2.17 USER MOD Set 3.2: C 97 CYS SG : rot -65:sc= 1.05 USER MOD Set 3.3: C 116 HIS : no HD1:sc= -0.927 K(o=-1.9,f=-2.7) USER MOD Set 3.4: C 119 CYS SG : rot 144:sc= -4.15! USER MOD Set 4.1: B 11 CYS SG : rot -173:sc= 0.692 USER MOD Set 4.2: B 14 CYS SG : rot 130:sc= -0.451 USER MOD Set 4.3: B 27 HIS : no HE2:sc= -2.15! C(o=-2.2!,f=-6.4!) USER MOD Set 4.4: B 32 CYS SG : rot -43:sc= -0.266 USER MOD Set 5.1: A 231 TYR OH : rot 150:sc= 0.00148 USER MOD Set 5.2: A 235 ASN : amide:sc= -0.0283 K(o=-1.6,f=-2.8) USER MOD Set 5.3: A 237 GLN : amide:sc= -1.56! C(o=-1.6!,f=-5.2!) USER MOD Set 6.1: A 204 CYS SG : rot 149:sc= 2.31 USER MOD Set 6.2: A 207 CYS SG : rot -39:sc= 0.397 USER MOD Set 6.3: A 225 CYS SG : rot 176:sc= 1.34! USER MOD Set 6.4: A 228 CYS SG : rot 77:sc= -0.541 USER MOD Single : A 206 ASN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 210 THR OG1 : rot -24:sc= 0.248 USER MOD Single : A 212 THR OG1 : rot 177:sc= 0.792 USER MOD Single : A 220 THR OG1 : rot 180:sc= -0.164 USER MOD Single : A 222 HIS : no HD1:sc= 0.0114 K(o=0.011,f=-6!) USER MOD Single : A 223 TYR OH : rot -69:sc= 1.47 USER MOD Single : A 226 ASN : amide:sc= 1.02 K(o=1,f=-4.9!) USER MOD Single : A 232 HIS : no HD1:sc= -0.364 X(o=-0.36,f=0.0036) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 MET CE :methyl 156:sc= -0.165 (180deg=-0.71) USER MOD Single : A 238 ASN : amide:sc= -0.0352 K(o=-0.035,f=-0.69) USER MOD Single : B 1 GLY N :NH3+ -107:sc= 0.0989 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 MET CE :methyl -157:sc= -0.648 (180deg=-1.2) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 93:sc= 1.26 USER MOD Single : B 22 SER OG : rot 95:sc= 0.0751 USER MOD Single : B 23 THR OG1 : rot 136:sc= -1.98! USER MOD Single : B 28 GLN : amide:sc= 0.0963 X(o=0.096,f=-0.2) USER MOD Single : B 30 TYR OH : rot -131:sc= 1.28 USER MOD Single : B 31 TYR OH : rot -165:sc= 1.24 USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 HIS : no HD1:sc= -0.154 X(o=-0.15,f=-0.15) USER MOD Single : C 96 SER OG : rot 92:sc= 0.56 USER MOD Single : C 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 104 TYR OH : rot 180:sc= 0 USER MOD Single : C 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 107 THR OG1 : rot 180:sc= 0 USER MOD Single : C 108 MET CE :methyl 160:sc= -0.0992 (180deg=-0.497) USER MOD Single : C 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 121 LYS NZ :NH3+ -150:sc= 1.01 (180deg=0.573) USER MOD Single : C 126 GLN : amide:sc= 0.793 K(o=0.79,f=0) USER MOD Single : C 127 LYS NZ :NH3+ -155:sc= 0.341 (180deg=-0.816) USER MOD Single : C 128 HIS : no HD1:sc= 0.44 K(o=0.45,f=-4.5!) USER MOD Single : C 130 SER OG : rot -169:sc= -0.0312 USER MOD Single : C 135 TYR OH : rot 165:sc= 0 USER MOD Single : C 139 ASN : amide:sc=-0.00642 X(o=-0.0064,f=-0.43) USER MOD Single : C 140 SER OG : rot 180:sc= 0.00568 USER MOD Single : C 149 TYR OH : rot 180:sc= 0 USER MOD Single : C 152 THR OG1 : rot -88:sc= 1.18 USER MOD Single : C 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 155 ASN : amide:sc= 1.15 K(o=1.1,f=-0.002) USER MOD Single : C 158 SER OG : rot 180:sc=-0.00303 USER MOD Single : C 161 SER OG : rot 180:sc= 0.0448 USER MOD Single : C 164 SER OG : rot 180:sc= 0.0456 USER MOD Single : C 169 MET CE :methyl -148:sc= 0 (180deg=-0.563) USER MOD Single : C 175 THR OG1 : rot 86:sc= 1.39 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 200 -5.123 6.585 7.567 1.00 0.91 N ATOM 2 CA GLU A 200 -4.607 5.203 7.473 1.00 0.71 C ATOM 3 C GLU A 200 -4.147 4.912 6.051 1.00 0.62 C ATOM 4 O GLU A 200 -4.217 5.783 5.184 1.00 0.70 O ATOM 5 CB GLU A 200 -5.682 4.205 7.912 1.00 0.79 C ATOM 6 CG GLU A 200 -6.178 4.449 9.329 1.00 0.88 C ATOM 7 CD GLU A 200 -5.046 4.686 10.314 1.00 1.29 C ATOM 8 OE1 GLU A 200 -4.502 5.813 10.338 1.00 1.61 O ATOM 9 OE2 GLU A 200 -4.694 3.754 11.058 1.00 1.63 O ATOM 0 HA GLU A 200 -3.751 5.098 8.140 1.00 0.71 H new ATOM 0 HB2 GLU A 200 -6.525 4.262 7.223 1.00 0.79 H new ATOM 0 HB3 GLU A 200 -5.281 3.194 7.843 1.00 0.79 H new ATOM 0 HG2 GLU A 200 -6.844 5.312 9.333 1.00 0.88 H new ATOM 0 HG3 GLU A 200 -6.766 3.591 9.657 1.00 0.88 H new ATOM 18 N ALA A 201 -3.679 3.692 5.812 1.00 0.56 N ATOM 19 CA ALA A 201 -3.194 3.312 4.491 1.00 0.57 C ATOM 20 C ALA A 201 -4.350 3.024 3.535 1.00 0.57 C ATOM 21 O ALA A 201 -4.755 3.887 2.756 1.00 0.89 O ATOM 22 CB ALA A 201 -2.266 2.109 4.600 1.00 0.62 C ATOM 0 H ALA A 201 -3.625 2.952 6.512 1.00 0.56 H new ATOM 0 HA ALA A 201 -2.633 4.151 4.080 1.00 0.57 H new ATOM 0 HB1 ALA A 201 -1.909 1.833 3.608 1.00 0.62 H new ATOM 0 HB2 ALA A 201 -1.416 2.361 5.234 1.00 0.62 H new ATOM 0 HB3 ALA A 201 -2.808 1.270 5.037 1.00 0.62 H new ATOM 28 N ARG A 202 -4.889 1.818 3.607 1.00 0.40 N ATOM 29 CA ARG A 202 -5.988 1.415 2.743 1.00 0.35 C ATOM 30 C ARG A 202 -7.065 0.732 3.574 1.00 0.33 C ATOM 31 O ARG A 202 -6.949 0.655 4.801 1.00 0.33 O ATOM 32 CB ARG A 202 -5.477 0.470 1.648 1.00 0.37 C ATOM 33 CG ARG A 202 -5.967 0.813 0.249 1.00 0.36 C ATOM 34 CD ARG A 202 -5.007 1.745 -0.476 1.00 0.28 C ATOM 35 NE ARG A 202 -4.963 3.070 0.141 1.00 0.46 N ATOM 36 CZ ARG A 202 -4.556 4.177 -0.478 1.00 0.44 C ATOM 37 NH1 ARG A 202 -4.097 4.126 -1.721 1.00 0.42 N ATOM 38 NH2 ARG A 202 -4.585 5.341 0.157 1.00 0.72 N ATOM 0 H ARG A 202 -4.581 1.096 4.259 1.00 0.40 H new ATOM 0 HA ARG A 202 -6.415 2.297 2.266 1.00 0.35 H new ATOM 0 HB2 ARG A 202 -4.387 0.483 1.652 1.00 0.37 H new ATOM 0 HB3 ARG A 202 -5.785 -0.547 1.889 1.00 0.37 H new ATOM 0 HG2 ARG A 202 -6.088 -0.104 -0.328 1.00 0.36 H new ATOM 0 HG3 ARG A 202 -6.949 1.282 0.313 1.00 0.36 H new ATOM 0 HD2 ARG A 202 -4.008 1.310 -0.474 1.00 0.28 H new ATOM 0 HD3 ARG A 202 -5.311 1.840 -1.518 1.00 0.28 H new ATOM 0 HE ARG A 202 -5.265 3.152 1.112 1.00 0.46 H new ATOM 0 HH11 ARG A 202 -4.053 3.233 -2.212 1.00 0.42 H new ATOM 0 HH12 ARG A 202 -3.788 4.980 -2.186 1.00 0.42 H new ATOM 0 HH21 ARG A 202 -4.919 5.389 1.120 1.00 0.72 H new ATOM 0 HH22 ARG A 202 -4.273 6.189 -0.317 1.00 0.72 H new ATOM 52 N GLU A 203 -8.103 0.254 2.916 1.00 0.37 N ATOM 53 CA GLU A 203 -9.193 -0.429 3.592 1.00 0.39 C ATOM 54 C GLU A 203 -9.318 -1.858 3.074 1.00 0.37 C ATOM 55 O GLU A 203 -8.615 -2.248 2.141 1.00 0.36 O ATOM 56 CB GLU A 203 -10.518 0.321 3.381 1.00 0.48 C ATOM 57 CG GLU A 203 -10.355 1.754 2.884 1.00 0.49 C ATOM 58 CD GLU A 203 -10.304 1.852 1.370 1.00 0.51 C ATOM 59 OE1 GLU A 203 -9.210 1.681 0.791 1.00 0.55 O ATOM 60 OE2 GLU A 203 -11.358 2.112 0.752 1.00 0.53 O ATOM 0 H GLU A 203 -8.216 0.326 1.905 1.00 0.37 H new ATOM 0 HA GLU A 203 -8.973 -0.453 4.659 1.00 0.39 H new ATOM 0 HB2 GLU A 203 -11.126 -0.233 2.665 1.00 0.48 H new ATOM 0 HB3 GLU A 203 -11.068 0.335 4.322 1.00 0.48 H new ATOM 0 HG2 GLU A 203 -11.183 2.358 3.254 1.00 0.49 H new ATOM 0 HG3 GLU A 203 -9.441 2.176 3.301 1.00 0.49 H new ATOM 67 N CYS A 204 -10.205 -2.629 3.689 1.00 0.39 N ATOM 68 CA CYS A 204 -10.450 -4.004 3.287 1.00 0.39 C ATOM 69 C CYS A 204 -11.892 -4.122 2.819 1.00 0.42 C ATOM 70 O CYS A 204 -12.765 -3.394 3.296 1.00 0.54 O ATOM 71 CB CYS A 204 -10.177 -4.969 4.452 1.00 0.41 C ATOM 72 SG CYS A 204 -10.668 -6.704 4.151 1.00 0.46 S ATOM 0 H CYS A 204 -10.772 -2.318 4.478 1.00 0.39 H new ATOM 0 HA CYS A 204 -9.776 -4.273 2.474 1.00 0.39 H new ATOM 0 HB2 CYS A 204 -9.112 -4.944 4.683 1.00 0.41 H new ATOM 0 HB3 CYS A 204 -10.703 -4.606 5.335 1.00 0.41 H new ATOM 0 HG CYS A 204 -9.878 -7.499 4.809 1.00 0.46 H new ATOM 77 N VAL A 205 -12.140 -5.031 1.893 1.00 0.38 N ATOM 78 CA VAL A 205 -13.480 -5.227 1.362 1.00 0.40 C ATOM 79 C VAL A 205 -14.399 -5.857 2.401 1.00 0.48 C ATOM 80 O VAL A 205 -15.624 -5.747 2.311 1.00 0.52 O ATOM 81 CB VAL A 205 -13.472 -6.119 0.102 1.00 0.38 C ATOM 82 CG1 VAL A 205 -12.649 -5.488 -1.010 1.00 0.36 C ATOM 83 CG2 VAL A 205 -12.954 -7.510 0.422 1.00 0.47 C ATOM 0 H VAL A 205 -11.432 -5.646 1.492 1.00 0.38 H new ATOM 0 HA VAL A 205 -13.853 -4.238 1.095 1.00 0.40 H new ATOM 0 HB VAL A 205 -14.501 -6.209 -0.245 1.00 0.38 H new ATOM 0 HG11 VAL A 205 -12.661 -6.138 -1.885 1.00 0.36 H new ATOM 0 HG12 VAL A 205 -13.074 -4.519 -1.272 1.00 0.36 H new ATOM 0 HG13 VAL A 205 -11.622 -5.354 -0.671 1.00 0.36 H new ATOM 0 HG21 VAL A 205 -12.959 -8.117 -0.483 1.00 0.47 H new ATOM 0 HG22 VAL A 205 -11.936 -7.440 0.806 1.00 0.47 H new ATOM 0 HG23 VAL A 205 -13.594 -7.973 1.173 1.00 0.47 H new ATOM 93 N ASN A 206 -13.806 -6.504 3.394 1.00 0.51 N ATOM 94 CA ASN A 206 -14.582 -7.165 4.425 1.00 0.60 C ATOM 95 C ASN A 206 -14.402 -6.506 5.783 1.00 0.63 C ATOM 96 O ASN A 206 -15.298 -6.577 6.624 1.00 0.72 O ATOM 97 CB ASN A 206 -14.198 -8.637 4.511 1.00 0.65 C ATOM 98 CG ASN A 206 -15.209 -9.554 3.848 1.00 0.79 C ATOM 99 OD1 ASN A 206 -15.037 -9.790 2.557 1.00 0.88 O flip ATOM 100 ND2 ASN A 206 -16.127 -10.060 4.495 1.00 1.26 N flip ATOM 0 H ASN A 206 -12.795 -6.583 3.505 1.00 0.51 H new ATOM 0 HA ASN A 206 -15.633 -7.076 4.148 1.00 0.60 H new ATOM 0 HB2 ASN A 206 -13.224 -8.781 4.043 1.00 0.65 H new ATOM 0 HB3 ASN A 206 -14.093 -8.919 5.559 1.00 0.65 H new ATOM 0 HD21 ASN A 206 -16.225 -9.853 5.489 1.00 1.26 H new ATOM 0 HD22 ASN A 206 -16.789 -10.686 4.037 1.00 1.26 H new ATOM 107 N CYS A 207 -13.257 -5.874 6.014 1.00 0.57 N ATOM 108 CA CYS A 207 -13.036 -5.226 7.295 1.00 0.61 C ATOM 109 C CYS A 207 -12.329 -3.870 7.146 1.00 0.58 C ATOM 110 O CYS A 207 -12.980 -2.841 6.953 1.00 0.62 O ATOM 111 CB CYS A 207 -12.294 -6.179 8.258 1.00 0.63 C ATOM 112 SG CYS A 207 -10.531 -6.516 7.898 1.00 0.55 S ATOM 0 H CYS A 207 -12.487 -5.798 5.349 1.00 0.57 H new ATOM 0 HA CYS A 207 -14.009 -5.003 7.734 1.00 0.61 H new ATOM 0 HB2 CYS A 207 -12.361 -5.764 9.264 1.00 0.63 H new ATOM 0 HB3 CYS A 207 -12.825 -7.131 8.269 1.00 0.63 H new ATOM 0 HG CYS A 207 -10.363 -6.621 6.613 1.00 0.55 H new ATOM 117 N GLY A 208 -11.017 -3.873 7.252 1.00 0.54 N ATOM 118 CA GLY A 208 -10.248 -2.655 7.127 1.00 0.52 C ATOM 119 C GLY A 208 -9.085 -2.621 8.093 1.00 0.49 C ATOM 120 O GLY A 208 -8.774 -1.577 8.667 1.00 0.52 O ATOM 0 H GLY A 208 -10.460 -4.710 7.425 1.00 0.54 H new ATOM 0 HA2 GLY A 208 -9.875 -2.564 6.107 1.00 0.52 H new ATOM 0 HA3 GLY A 208 -10.895 -1.797 7.308 1.00 0.52 H new ATOM 124 N ALA A 209 -8.444 -3.768 8.279 1.00 0.47 N ATOM 125 CA ALA A 209 -7.314 -3.874 9.189 1.00 0.46 C ATOM 126 C ALA A 209 -6.043 -3.326 8.552 1.00 0.42 C ATOM 127 O ALA A 209 -5.326 -4.041 7.855 1.00 0.41 O ATOM 128 CB ALA A 209 -7.112 -5.321 9.616 1.00 0.49 C ATOM 0 H ALA A 209 -8.689 -4.640 7.810 1.00 0.47 H new ATOM 0 HA ALA A 209 -7.534 -3.274 10.072 1.00 0.46 H new ATOM 0 HB1 ALA A 209 -6.263 -5.384 10.297 1.00 0.49 H new ATOM 0 HB2 ALA A 209 -8.009 -5.680 10.120 1.00 0.49 H new ATOM 0 HB3 ALA A 209 -6.919 -5.936 8.737 1.00 0.49 H new ATOM 134 N THR A 210 -5.756 -2.054 8.806 1.00 0.45 N ATOM 135 CA THR A 210 -4.567 -1.420 8.254 1.00 0.48 C ATOM 136 C THR A 210 -3.314 -1.917 8.970 1.00 0.47 C ATOM 137 O THR A 210 -2.190 -1.632 8.551 1.00 0.47 O ATOM 138 CB THR A 210 -4.647 0.125 8.337 1.00 0.61 C ATOM 139 OG1 THR A 210 -3.568 0.717 7.599 1.00 0.67 O ATOM 140 CG2 THR A 210 -4.601 0.607 9.779 1.00 0.70 C ATOM 0 H THR A 210 -6.329 -1.444 9.389 1.00 0.45 H new ATOM 0 HA THR A 210 -4.512 -1.696 7.201 1.00 0.48 H new ATOM 0 HB THR A 210 -5.599 0.431 7.903 1.00 0.61 H new ATOM 0 HG1 THR A 210 -2.827 0.079 7.535 1.00 0.67 H new ATOM 0 HG21 THR A 210 -4.659 1.695 9.801 1.00 0.70 H new ATOM 0 HG22 THR A 210 -5.443 0.187 10.330 1.00 0.70 H new ATOM 0 HG23 THR A 210 -3.668 0.284 10.241 1.00 0.70 H new ATOM 148 N ALA A 211 -3.524 -2.684 10.036 1.00 0.49 N ATOM 149 CA ALA A 211 -2.430 -3.236 10.820 1.00 0.52 C ATOM 150 C ALA A 211 -1.793 -4.437 10.125 1.00 0.44 C ATOM 151 O ALA A 211 -0.767 -4.948 10.577 1.00 0.44 O ATOM 152 CB ALA A 211 -2.926 -3.623 12.204 1.00 0.64 C ATOM 0 H ALA A 211 -4.451 -2.937 10.377 1.00 0.49 H new ATOM 0 HA ALA A 211 -1.663 -2.468 10.917 1.00 0.52 H new ATOM 0 HB1 ALA A 211 -2.101 -4.035 12.784 1.00 0.64 H new ATOM 0 HB2 ALA A 211 -3.320 -2.741 12.709 1.00 0.64 H new ATOM 0 HB3 ALA A 211 -3.714 -4.371 12.112 1.00 0.64 H new ATOM 158 N THR A 212 -2.408 -4.889 9.033 1.00 0.42 N ATOM 159 CA THR A 212 -1.891 -6.021 8.273 1.00 0.41 C ATOM 160 C THR A 212 -0.468 -5.729 7.791 1.00 0.37 C ATOM 161 O THR A 212 -0.157 -4.596 7.426 1.00 0.34 O ATOM 162 CB THR A 212 -2.803 -6.357 7.064 1.00 0.40 C ATOM 163 OG1 THR A 212 -2.324 -7.525 6.381 1.00 0.46 O ATOM 164 CG2 THR A 212 -2.883 -5.194 6.080 1.00 0.30 C ATOM 0 H THR A 212 -3.266 -4.486 8.656 1.00 0.42 H new ATOM 0 HA THR A 212 -1.876 -6.887 8.934 1.00 0.41 H new ATOM 0 HB THR A 212 -3.802 -6.547 7.456 1.00 0.40 H new ATOM 0 HG1 THR A 212 -2.936 -7.750 5.650 1.00 0.46 H new ATOM 0 HG21 THR A 212 -3.530 -5.466 5.247 1.00 0.30 H new ATOM 0 HG22 THR A 212 -3.290 -4.318 6.585 1.00 0.30 H new ATOM 0 HG23 THR A 212 -1.885 -4.966 5.705 1.00 0.30 H new ATOM 172 N PRO A 213 0.423 -6.733 7.814 1.00 0.45 N ATOM 173 CA PRO A 213 1.814 -6.567 7.375 1.00 0.49 C ATOM 174 C PRO A 213 1.909 -6.016 5.950 1.00 0.49 C ATOM 175 O PRO A 213 2.762 -5.176 5.647 1.00 0.56 O ATOM 176 CB PRO A 213 2.400 -7.984 7.452 1.00 0.59 C ATOM 177 CG PRO A 213 1.229 -8.901 7.596 1.00 0.62 C ATOM 178 CD PRO A 213 0.157 -8.103 8.280 1.00 0.55 C ATOM 0 HA PRO A 213 2.350 -5.848 7.994 1.00 0.49 H new ATOM 0 HB2 PRO A 213 2.973 -8.219 6.555 1.00 0.59 H new ATOM 0 HB3 PRO A 213 3.079 -8.081 8.299 1.00 0.59 H new ATOM 0 HG2 PRO A 213 0.890 -9.256 6.623 1.00 0.62 H new ATOM 0 HG3 PRO A 213 1.493 -9.781 8.182 1.00 0.62 H new ATOM 0 HD2 PRO A 213 -0.840 -8.440 7.997 1.00 0.55 H new ATOM 0 HD3 PRO A 213 0.224 -8.181 9.365 1.00 0.55 H new ATOM 186 N LEU A 214 1.022 -6.482 5.084 1.00 0.43 N ATOM 187 CA LEU A 214 0.996 -6.038 3.701 1.00 0.44 C ATOM 188 C LEU A 214 -0.400 -6.215 3.129 1.00 0.39 C ATOM 189 O LEU A 214 -1.087 -7.180 3.453 1.00 0.46 O ATOM 190 CB LEU A 214 2.010 -6.814 2.855 1.00 0.53 C ATOM 191 CG LEU A 214 2.243 -6.254 1.446 1.00 0.63 C ATOM 192 CD1 LEU A 214 2.790 -4.835 1.518 1.00 0.74 C ATOM 193 CD2 LEU A 214 3.186 -7.153 0.666 1.00 0.74 C ATOM 0 H LEU A 214 0.307 -7.171 5.318 1.00 0.43 H new ATOM 0 HA LEU A 214 1.268 -4.983 3.675 1.00 0.44 H new ATOM 0 HB2 LEU A 214 2.963 -6.833 3.384 1.00 0.53 H new ATOM 0 HB3 LEU A 214 1.673 -7.847 2.768 1.00 0.53 H new ATOM 0 HG LEU A 214 1.287 -6.225 0.924 1.00 0.63 H new ATOM 0 HD11 LEU A 214 2.949 -4.455 0.509 1.00 0.74 H new ATOM 0 HD12 LEU A 214 2.077 -4.196 2.038 1.00 0.74 H new ATOM 0 HD13 LEU A 214 3.737 -4.837 2.058 1.00 0.74 H new ATOM 0 HD21 LEU A 214 3.340 -6.741 -0.331 1.00 0.74 H new ATOM 0 HD22 LEU A 214 4.143 -7.215 1.185 1.00 0.74 H new ATOM 0 HD23 LEU A 214 2.753 -8.150 0.583 1.00 0.74 H new ATOM 205 N TRP A 215 -0.813 -5.281 2.288 1.00 0.31 N ATOM 206 CA TRP A 215 -2.131 -5.335 1.677 1.00 0.27 C ATOM 207 C TRP A 215 -2.179 -6.386 0.582 1.00 0.32 C ATOM 208 O TRP A 215 -1.301 -6.443 -0.281 1.00 0.40 O ATOM 209 CB TRP A 215 -2.511 -3.971 1.104 1.00 0.25 C ATOM 210 CG TRP A 215 -2.820 -2.959 2.162 1.00 0.28 C ATOM 211 CD1 TRP A 215 -2.084 -1.857 2.489 1.00 0.36 C ATOM 212 CD2 TRP A 215 -3.947 -2.969 3.040 1.00 0.31 C ATOM 213 NE1 TRP A 215 -2.688 -1.177 3.518 1.00 0.41 N ATOM 214 CE2 TRP A 215 -3.837 -1.841 3.872 1.00 0.38 C ATOM 215 CE3 TRP A 215 -5.043 -3.820 3.199 1.00 0.37 C ATOM 216 CZ2 TRP A 215 -4.779 -1.546 4.849 1.00 0.45 C ATOM 217 CZ3 TRP A 215 -5.978 -3.526 4.171 1.00 0.46 C ATOM 218 CH2 TRP A 215 -5.842 -2.397 4.983 1.00 0.48 C ATOM 0 H TRP A 215 -0.253 -4.474 2.012 1.00 0.31 H new ATOM 0 HA TRP A 215 -2.848 -5.608 2.451 1.00 0.27 H new ATOM 0 HB2 TRP A 215 -1.694 -3.603 0.484 1.00 0.25 H new ATOM 0 HB3 TRP A 215 -3.378 -4.085 0.453 1.00 0.25 H new ATOM 0 HD1 TRP A 215 -1.162 -1.563 2.009 1.00 0.36 H new ATOM 0 HE1 TRP A 215 -2.341 -0.320 3.948 1.00 0.41 H new ATOM 0 HE3 TRP A 215 -5.157 -4.692 2.573 1.00 0.37 H new ATOM 0 HZ2 TRP A 215 -4.676 -0.676 5.480 1.00 0.45 H new ATOM 0 HZ3 TRP A 215 -6.828 -4.179 4.306 1.00 0.46 H new ATOM 0 HH2 TRP A 215 -6.592 -2.192 5.732 1.00 0.48 H new ATOM 229 N ARG A 216 -3.203 -7.219 0.622 1.00 0.33 N ATOM 230 CA ARG A 216 -3.375 -8.264 -0.369 1.00 0.39 C ATOM 231 C ARG A 216 -4.166 -7.719 -1.546 1.00 0.37 C ATOM 232 O ARG A 216 -5.364 -7.957 -1.669 1.00 0.46 O ATOM 233 CB ARG A 216 -4.081 -9.479 0.242 1.00 0.46 C ATOM 234 CG ARG A 216 -3.133 -10.492 0.868 1.00 0.55 C ATOM 235 CD ARG A 216 -2.265 -9.861 1.948 1.00 0.57 C ATOM 236 NE ARG A 216 -1.222 -10.773 2.417 1.00 0.55 N ATOM 237 CZ ARG A 216 0.006 -10.835 1.897 1.00 0.73 C ATOM 238 NH1 ARG A 216 0.348 -10.042 0.889 1.00 1.02 N ATOM 239 NH2 ARG A 216 0.893 -11.687 2.390 1.00 0.80 N ATOM 0 H ARG A 216 -3.932 -7.191 1.335 1.00 0.33 H new ATOM 0 HA ARG A 216 -2.395 -8.589 -0.718 1.00 0.39 H new ATOM 0 HB2 ARG A 216 -4.783 -9.135 1.002 1.00 0.46 H new ATOM 0 HB3 ARG A 216 -4.667 -9.974 -0.532 1.00 0.46 H new ATOM 0 HG2 ARG A 216 -3.709 -11.312 1.297 1.00 0.55 H new ATOM 0 HG3 ARG A 216 -2.496 -10.921 0.094 1.00 0.55 H new ATOM 0 HD2 ARG A 216 -1.804 -8.953 1.558 1.00 0.57 H new ATOM 0 HD3 ARG A 216 -2.892 -9.564 2.789 1.00 0.57 H new ATOM 0 HE ARG A 216 -1.447 -11.400 3.189 1.00 0.55 H new ATOM 0 HH11 ARG A 216 -0.329 -9.381 0.508 1.00 1.02 H new ATOM 0 HH12 ARG A 216 1.288 -10.094 0.496 1.00 1.02 H new ATOM 0 HH21 ARG A 216 0.638 -12.296 3.167 1.00 0.80 H new ATOM 0 HH22 ARG A 216 1.831 -11.734 1.992 1.00 0.80 H new ATOM 253 N ARG A 217 -3.487 -6.957 -2.387 1.00 0.38 N ATOM 254 CA ARG A 217 -4.113 -6.353 -3.553 1.00 0.39 C ATOM 255 C ARG A 217 -3.895 -7.211 -4.792 1.00 0.44 C ATOM 256 O ARG A 217 -2.763 -7.567 -5.121 1.00 0.50 O ATOM 257 CB ARG A 217 -3.542 -4.951 -3.781 1.00 0.43 C ATOM 258 CG ARG A 217 -4.156 -4.219 -4.964 1.00 0.45 C ATOM 259 CD ARG A 217 -3.094 -3.763 -5.953 1.00 0.43 C ATOM 260 NE ARG A 217 -3.230 -2.347 -6.294 1.00 0.52 N ATOM 261 CZ ARG A 217 -3.604 -1.900 -7.496 1.00 1.07 C ATOM 262 NH1 ARG A 217 -3.946 -2.760 -8.458 1.00 1.43 N ATOM 263 NH2 ARG A 217 -3.657 -0.593 -7.731 1.00 1.46 N ATOM 0 H ARG A 217 -2.496 -6.741 -2.283 1.00 0.38 H new ATOM 0 HA ARG A 217 -5.185 -6.282 -3.371 1.00 0.39 H new ATOM 0 HB2 ARG A 217 -3.694 -4.357 -2.880 1.00 0.43 H new ATOM 0 HB3 ARG A 217 -2.466 -5.028 -3.934 1.00 0.43 H new ATOM 0 HG2 ARG A 217 -4.867 -4.874 -5.469 1.00 0.45 H new ATOM 0 HG3 ARG A 217 -4.716 -3.355 -4.607 1.00 0.45 H new ATOM 0 HD2 ARG A 217 -2.105 -3.940 -5.530 1.00 0.43 H new ATOM 0 HD3 ARG A 217 -3.164 -4.362 -6.861 1.00 0.43 H new ATOM 0 HE ARG A 217 -3.027 -1.659 -5.569 1.00 0.52 H new ATOM 0 HH11 ARG A 217 -3.922 -3.764 -8.277 1.00 1.43 H new ATOM 0 HH12 ARG A 217 -4.231 -2.414 -9.374 1.00 1.43 H new ATOM 0 HH21 ARG A 217 -3.412 0.068 -6.994 1.00 1.46 H new ATOM 0 HH22 ARG A 217 -3.942 -0.251 -8.649 1.00 1.46 H new ATOM 277 N ASP A 218 -4.982 -7.540 -5.470 1.00 0.44 N ATOM 278 CA ASP A 218 -4.913 -8.342 -6.683 1.00 0.50 C ATOM 279 C ASP A 218 -4.762 -7.434 -7.908 1.00 0.54 C ATOM 280 O ASP A 218 -4.467 -6.241 -7.778 1.00 0.57 O ATOM 281 CB ASP A 218 -6.164 -9.218 -6.817 1.00 0.51 C ATOM 282 CG ASP A 218 -7.320 -8.474 -7.448 1.00 0.51 C ATOM 283 OD1 ASP A 218 -7.739 -7.444 -6.893 1.00 0.48 O ATOM 284 OD2 ASP A 218 -7.792 -8.898 -8.522 1.00 0.59 O ATOM 0 H ASP A 218 -5.926 -7.264 -5.201 1.00 0.44 H new ATOM 0 HA ASP A 218 -4.042 -8.994 -6.622 1.00 0.50 H new ATOM 0 HB2 ASP A 218 -5.928 -10.096 -7.419 1.00 0.51 H new ATOM 0 HB3 ASP A 218 -6.461 -9.578 -5.832 1.00 0.51 H new ATOM 289 N ARG A 219 -4.973 -7.997 -9.093 1.00 0.60 N ATOM 290 CA ARG A 219 -4.850 -7.243 -10.333 1.00 0.65 C ATOM 291 C ARG A 219 -6.011 -6.262 -10.521 1.00 0.63 C ATOM 292 O ARG A 219 -5.815 -5.160 -11.034 1.00 0.68 O ATOM 293 CB ARG A 219 -4.780 -8.193 -11.530 1.00 0.72 C ATOM 294 CG ARG A 219 -4.286 -7.525 -12.804 1.00 0.86 C ATOM 295 CD ARG A 219 -4.875 -8.174 -14.043 1.00 0.94 C ATOM 296 NE ARG A 219 -5.554 -7.201 -14.895 1.00 0.91 N ATOM 297 CZ ARG A 219 -6.322 -7.522 -15.932 1.00 1.12 C ATOM 298 NH1 ARG A 219 -6.525 -8.797 -16.249 1.00 1.57 N ATOM 299 NH2 ARG A 219 -6.886 -6.563 -16.653 1.00 1.34 N ATOM 0 H ARG A 219 -5.231 -8.976 -9.220 1.00 0.60 H new ATOM 0 HA ARG A 219 -3.927 -6.666 -10.271 1.00 0.65 H new ATOM 0 HB2 ARG A 219 -4.120 -9.025 -11.286 1.00 0.72 H new ATOM 0 HB3 ARG A 219 -5.770 -8.613 -11.709 1.00 0.72 H new ATOM 0 HG2 ARG A 219 -4.550 -6.468 -12.786 1.00 0.86 H new ATOM 0 HG3 ARG A 219 -3.198 -7.581 -12.846 1.00 0.86 H new ATOM 0 HD2 ARG A 219 -4.082 -8.662 -14.609 1.00 0.94 H new ATOM 0 HD3 ARG A 219 -5.579 -8.951 -13.746 1.00 0.94 H new ATOM 0 HE ARG A 219 -5.431 -6.211 -14.681 1.00 0.91 H new ATOM 0 HH11 ARG A 219 -6.091 -9.536 -15.696 1.00 1.57 H new ATOM 0 HH12 ARG A 219 -7.115 -9.037 -17.046 1.00 1.57 H new ATOM 0 HH21 ARG A 219 -6.730 -5.584 -16.411 1.00 1.34 H new ATOM 0 HH22 ARG A 219 -7.476 -6.804 -17.449 1.00 1.34 H new ATOM 313 N THR A 220 -7.212 -6.652 -10.101 1.00 0.59 N ATOM 314 CA THR A 220 -8.379 -5.787 -10.251 1.00 0.62 C ATOM 315 C THR A 220 -8.287 -4.592 -9.311 1.00 0.58 C ATOM 316 O THR A 220 -8.658 -3.471 -9.670 1.00 0.70 O ATOM 317 CB THR A 220 -9.705 -6.542 -9.999 1.00 0.65 C ATOM 318 OG1 THR A 220 -9.759 -7.037 -8.656 1.00 0.82 O ATOM 319 CG2 THR A 220 -9.866 -7.700 -10.973 1.00 0.90 C ATOM 0 H THR A 220 -7.402 -7.551 -9.659 1.00 0.59 H new ATOM 0 HA THR A 220 -8.381 -5.441 -11.284 1.00 0.62 H new ATOM 0 HB THR A 220 -10.521 -5.835 -10.153 1.00 0.65 H new ATOM 0 HG1 THR A 220 -10.606 -7.510 -8.516 1.00 0.82 H new ATOM 0 HG21 THR A 220 -10.806 -8.214 -10.774 1.00 0.90 H new ATOM 0 HG22 THR A 220 -9.869 -7.319 -11.994 1.00 0.90 H new ATOM 0 HG23 THR A 220 -9.038 -8.398 -10.849 1.00 0.90 H new ATOM 327 N GLY A 221 -7.779 -4.831 -8.110 1.00 0.47 N ATOM 328 CA GLY A 221 -7.639 -3.761 -7.146 1.00 0.44 C ATOM 329 C GLY A 221 -8.326 -4.072 -5.836 1.00 0.41 C ATOM 330 O GLY A 221 -8.544 -3.183 -5.014 1.00 0.43 O ATOM 0 H GLY A 221 -7.462 -5.745 -7.787 1.00 0.47 H new ATOM 0 HA2 GLY A 221 -6.580 -3.577 -6.963 1.00 0.44 H new ATOM 0 HA3 GLY A 221 -8.055 -2.844 -7.563 1.00 0.44 H new ATOM 334 N HIS A 222 -8.662 -5.337 -5.638 1.00 0.41 N ATOM 335 CA HIS A 222 -9.320 -5.778 -4.418 1.00 0.41 C ATOM 336 C HIS A 222 -8.353 -5.715 -3.250 1.00 0.37 C ATOM 337 O HIS A 222 -7.532 -6.612 -3.072 1.00 0.42 O ATOM 338 CB HIS A 222 -9.839 -7.213 -4.569 1.00 0.48 C ATOM 339 CG HIS A 222 -11.315 -7.308 -4.793 1.00 0.60 C ATOM 340 ND1 HIS A 222 -12.098 -8.296 -4.233 1.00 0.75 N ATOM 341 CD2 HIS A 222 -12.153 -6.536 -5.524 1.00 0.72 C ATOM 342 CE1 HIS A 222 -13.349 -8.129 -4.612 1.00 0.90 C ATOM 343 NE2 HIS A 222 -13.411 -7.069 -5.393 1.00 0.90 N ATOM 0 H HIS A 222 -8.488 -6.082 -6.313 1.00 0.41 H new ATOM 0 HA HIS A 222 -10.164 -5.114 -4.230 1.00 0.41 H new ATOM 0 HB2 HIS A 222 -9.324 -7.688 -5.404 1.00 0.48 H new ATOM 0 HB3 HIS A 222 -9.581 -7.777 -3.673 1.00 0.48 H new ATOM 0 HD2 HIS A 222 -11.883 -5.665 -6.102 1.00 0.72 H new ATOM 0 HE1 HIS A 222 -14.183 -8.755 -4.330 1.00 0.90 H new ATOM 0 HE2 HIS A 222 -14.257 -6.704 -5.830 1.00 0.90 H new ATOM 352 N TYR A 223 -8.424 -4.639 -2.480 1.00 0.33 N ATOM 353 CA TYR A 223 -7.559 -4.479 -1.325 1.00 0.29 C ATOM 354 C TYR A 223 -8.098 -5.296 -0.165 1.00 0.31 C ATOM 355 O TYR A 223 -9.194 -5.040 0.335 1.00 0.33 O ATOM 356 CB TYR A 223 -7.430 -3.004 -0.939 1.00 0.28 C ATOM 357 CG TYR A 223 -6.428 -2.251 -1.785 1.00 0.32 C ATOM 358 CD1 TYR A 223 -5.065 -2.375 -1.547 1.00 0.45 C ATOM 359 CD2 TYR A 223 -6.840 -1.426 -2.824 1.00 0.40 C ATOM 360 CE1 TYR A 223 -4.141 -1.698 -2.318 1.00 0.58 C ATOM 361 CE2 TYR A 223 -5.919 -0.745 -3.600 1.00 0.54 C ATOM 362 CZ TYR A 223 -4.572 -0.885 -3.344 1.00 0.60 C ATOM 363 OH TYR A 223 -3.652 -0.212 -4.116 1.00 0.78 O ATOM 0 H TYR A 223 -9.071 -3.866 -2.635 1.00 0.33 H new ATOM 0 HA TYR A 223 -6.563 -4.842 -1.579 1.00 0.29 H new ATOM 0 HB2 TYR A 223 -8.405 -2.525 -1.030 1.00 0.28 H new ATOM 0 HB3 TYR A 223 -7.137 -2.934 0.108 1.00 0.28 H new ATOM 0 HD1 TYR A 223 -4.722 -3.012 -0.745 1.00 0.45 H new ATOM 0 HD2 TYR A 223 -7.895 -1.315 -3.029 1.00 0.40 H new ATOM 0 HE1 TYR A 223 -3.085 -1.805 -2.118 1.00 0.58 H new ATOM 0 HE2 TYR A 223 -6.254 -0.106 -4.403 1.00 0.54 H new ATOM 0 HH TYR A 223 -3.218 0.482 -3.577 1.00 0.78 H new ATOM 373 N LEU A 224 -7.349 -6.315 0.215 1.00 0.33 N ATOM 374 CA LEU A 224 -7.731 -7.183 1.312 1.00 0.37 C ATOM 375 C LEU A 224 -6.672 -7.129 2.402 1.00 0.36 C ATOM 376 O LEU A 224 -5.488 -6.959 2.109 1.00 0.34 O ATOM 377 CB LEU A 224 -7.895 -8.623 0.815 1.00 0.42 C ATOM 378 CG LEU A 224 -8.848 -8.803 -0.368 1.00 0.48 C ATOM 379 CD1 LEU A 224 -8.195 -9.640 -1.457 1.00 0.52 C ATOM 380 CD2 LEU A 224 -10.142 -9.453 0.086 1.00 0.61 C ATOM 0 H LEU A 224 -6.463 -6.563 -0.226 1.00 0.33 H new ATOM 0 HA LEU A 224 -8.683 -6.842 1.718 1.00 0.37 H new ATOM 0 HB2 LEU A 224 -6.915 -9.006 0.532 1.00 0.42 H new ATOM 0 HB3 LEU A 224 -8.250 -9.237 1.643 1.00 0.42 H new ATOM 0 HG LEU A 224 -9.076 -7.818 -0.776 1.00 0.48 H new ATOM 0 HD11 LEU A 224 -8.888 -9.757 -2.290 1.00 0.52 H new ATOM 0 HD12 LEU A 224 -7.290 -9.142 -1.805 1.00 0.52 H new ATOM 0 HD13 LEU A 224 -7.939 -10.621 -1.057 1.00 0.52 H new ATOM 0 HD21 LEU A 224 -10.808 -9.573 -0.768 1.00 0.61 H new ATOM 0 HD22 LEU A 224 -9.926 -10.430 0.518 1.00 0.61 H new ATOM 0 HD23 LEU A 224 -10.622 -8.823 0.835 1.00 0.61 H new ATOM 392 N CYS A 225 -7.101 -7.267 3.647 1.00 0.38 N ATOM 393 CA CYS A 225 -6.191 -7.242 4.781 1.00 0.38 C ATOM 394 C CYS A 225 -5.222 -8.425 4.708 1.00 0.41 C ATOM 395 O CYS A 225 -4.056 -8.286 4.335 1.00 0.39 O ATOM 396 CB CYS A 225 -7.007 -7.311 6.074 1.00 0.43 C ATOM 397 SG CYS A 225 -8.200 -8.694 6.110 1.00 0.51 S ATOM 0 H CYS A 225 -8.081 -7.398 3.898 1.00 0.38 H new ATOM 0 HA CYS A 225 -5.610 -6.320 4.762 1.00 0.38 H new ATOM 0 HB2 CYS A 225 -6.326 -7.407 6.919 1.00 0.43 H new ATOM 0 HB3 CYS A 225 -7.546 -6.373 6.204 1.00 0.43 H new ATOM 0 HG CYS A 225 -8.786 -8.731 7.270 1.00 0.51 H new ATOM 402 N ASN A 226 -5.743 -9.583 5.069 1.00 0.47 N ATOM 403 CA ASN A 226 -5.011 -10.840 5.060 1.00 0.51 C ATOM 404 C ASN A 226 -5.980 -11.954 5.419 1.00 0.59 C ATOM 405 O ASN A 226 -6.028 -12.992 4.760 1.00 0.64 O ATOM 406 CB ASN A 226 -3.841 -10.823 6.051 1.00 0.51 C ATOM 407 CG ASN A 226 -2.792 -11.873 5.726 1.00 0.54 C ATOM 408 OD1 ASN A 226 -2.366 -12.017 4.580 1.00 0.63 O ATOM 409 ND2 ASN A 226 -2.375 -12.625 6.731 1.00 0.68 N ATOM 0 H ASN A 226 -6.708 -9.680 5.384 1.00 0.47 H new ATOM 0 HA ASN A 226 -4.589 -10.999 4.068 1.00 0.51 H new ATOM 0 HB2 ASN A 226 -3.378 -9.836 6.045 1.00 0.51 H new ATOM 0 HB3 ASN A 226 -4.220 -10.991 7.059 1.00 0.51 H new ATOM 0 HD21 ASN A 226 -1.678 -13.352 6.569 1.00 0.68 H new ATOM 0 HD22 ASN A 226 -2.750 -12.478 7.668 1.00 0.68 H new ATOM 416 N ALA A 227 -6.777 -11.707 6.456 1.00 0.61 N ATOM 417 CA ALA A 227 -7.770 -12.669 6.910 1.00 0.68 C ATOM 418 C ALA A 227 -8.860 -12.833 5.859 1.00 0.68 C ATOM 419 O ALA A 227 -9.099 -13.936 5.368 1.00 0.73 O ATOM 420 CB ALA A 227 -8.372 -12.234 8.237 1.00 0.70 C ATOM 0 H ALA A 227 -6.752 -10.843 6.998 1.00 0.61 H new ATOM 0 HA ALA A 227 -7.278 -13.630 7.058 1.00 0.68 H new ATOM 0 HB1 ALA A 227 -9.112 -12.967 8.559 1.00 0.70 H new ATOM 0 HB2 ALA A 227 -7.585 -12.160 8.987 1.00 0.70 H new ATOM 0 HB3 ALA A 227 -8.852 -11.263 8.118 1.00 0.70 H new ATOM 426 N CYS A 228 -9.508 -11.727 5.495 1.00 0.64 N ATOM 427 CA CYS A 228 -10.553 -11.764 4.485 1.00 0.65 C ATOM 428 C CYS A 228 -9.932 -11.973 3.103 1.00 0.64 C ATOM 429 O CYS A 228 -10.626 -12.270 2.136 1.00 0.69 O ATOM 430 CB CYS A 228 -11.373 -10.473 4.497 1.00 0.62 C ATOM 431 SG CYS A 228 -11.589 -9.715 6.144 1.00 0.62 S ATOM 0 H CYS A 228 -9.326 -10.802 5.884 1.00 0.64 H new ATOM 0 HA CYS A 228 -11.221 -12.595 4.713 1.00 0.65 H new ATOM 0 HB2 CYS A 228 -10.892 -9.748 3.840 1.00 0.62 H new ATOM 0 HB3 CYS A 228 -12.357 -10.681 4.077 1.00 0.62 H new ATOM 0 HG CYS A 228 -10.492 -9.109 6.490 1.00 0.62 H new ATOM 436 N GLY A 229 -8.616 -11.819 3.028 1.00 0.61 N ATOM 437 CA GLY A 229 -7.912 -12.003 1.776 1.00 0.63 C ATOM 438 C GLY A 229 -7.994 -13.431 1.286 1.00 0.69 C ATOM 439 O GLY A 229 -8.013 -13.684 0.082 1.00 0.70 O ATOM 0 H GLY A 229 -8.022 -11.568 3.818 1.00 0.61 H new ATOM 0 HA2 GLY A 229 -8.331 -11.336 1.023 1.00 0.63 H new ATOM 0 HA3 GLY A 229 -6.866 -11.723 1.903 1.00 0.63 H new ATOM 443 N LEU A 230 -8.060 -14.364 2.224 1.00 0.74 N ATOM 444 CA LEU A 230 -8.146 -15.775 1.889 1.00 0.82 C ATOM 445 C LEU A 230 -9.551 -16.146 1.416 1.00 0.83 C ATOM 446 O LEU A 230 -9.764 -17.219 0.856 1.00 0.90 O ATOM 447 CB LEU A 230 -7.746 -16.632 3.091 1.00 0.90 C ATOM 448 CG LEU A 230 -6.265 -16.562 3.478 1.00 0.95 C ATOM 449 CD1 LEU A 230 -6.029 -17.263 4.804 1.00 1.09 C ATOM 450 CD2 LEU A 230 -5.398 -17.183 2.394 1.00 0.98 C ATOM 0 H LEU A 230 -8.056 -14.167 3.225 1.00 0.74 H new ATOM 0 HA LEU A 230 -7.453 -15.970 1.071 1.00 0.82 H new ATOM 0 HB2 LEU A 230 -8.344 -16.327 3.950 1.00 0.90 H new ATOM 0 HB3 LEU A 230 -8.001 -17.670 2.878 1.00 0.90 H new ATOM 0 HG LEU A 230 -5.989 -15.513 3.584 1.00 0.95 H new ATOM 0 HD11 LEU A 230 -4.972 -17.204 5.064 1.00 1.09 H new ATOM 0 HD12 LEU A 230 -6.621 -16.780 5.581 1.00 1.09 H new ATOM 0 HD13 LEU A 230 -6.324 -18.309 4.720 1.00 1.09 H new ATOM 0 HD21 LEU A 230 -4.350 -17.123 2.688 1.00 0.98 H new ATOM 0 HD22 LEU A 230 -5.678 -18.228 2.258 1.00 0.98 H new ATOM 0 HD23 LEU A 230 -5.544 -16.644 1.458 1.00 0.98 H new ATOM 462 N TYR A 231 -10.502 -15.247 1.631 1.00 0.79 N ATOM 463 CA TYR A 231 -11.885 -15.468 1.224 1.00 0.82 C ATOM 464 C TYR A 231 -11.971 -15.541 -0.302 1.00 0.80 C ATOM 465 O TYR A 231 -12.789 -16.274 -0.863 1.00 0.85 O ATOM 466 CB TYR A 231 -12.767 -14.331 1.756 1.00 0.79 C ATOM 467 CG TYR A 231 -14.210 -14.712 1.988 1.00 0.90 C ATOM 468 CD1 TYR A 231 -14.610 -15.292 3.185 1.00 1.04 C ATOM 469 CD2 TYR A 231 -15.173 -14.480 1.019 1.00 0.96 C ATOM 470 CE1 TYR A 231 -15.932 -15.631 3.407 1.00 1.19 C ATOM 471 CE2 TYR A 231 -16.496 -14.817 1.232 1.00 1.11 C ATOM 472 CZ TYR A 231 -16.872 -15.392 2.428 1.00 1.20 C ATOM 473 OH TYR A 231 -18.191 -15.724 2.646 1.00 1.38 O ATOM 0 H TYR A 231 -10.340 -14.350 2.089 1.00 0.79 H new ATOM 0 HA TYR A 231 -12.239 -16.412 1.639 1.00 0.82 H new ATOM 0 HB2 TYR A 231 -12.345 -13.969 2.694 1.00 0.79 H new ATOM 0 HB3 TYR A 231 -12.733 -13.501 1.050 1.00 0.79 H new ATOM 0 HD1 TYR A 231 -13.877 -15.481 3.955 1.00 1.04 H new ATOM 0 HD2 TYR A 231 -14.885 -14.028 0.081 1.00 0.96 H new ATOM 0 HE1 TYR A 231 -16.227 -16.081 4.343 1.00 1.19 H new ATOM 0 HE2 TYR A 231 -17.233 -14.631 0.465 1.00 1.11 H new ATOM 0 HH TYR A 231 -18.770 -15.111 2.146 1.00 1.38 H new ATOM 483 N HIS A 232 -11.079 -14.808 -0.961 1.00 0.74 N ATOM 484 CA HIS A 232 -11.038 -14.754 -2.418 1.00 0.73 C ATOM 485 C HIS A 232 -10.226 -15.921 -2.992 1.00 0.75 C ATOM 486 O HIS A 232 -10.106 -16.067 -4.208 1.00 0.77 O ATOM 487 CB HIS A 232 -10.426 -13.415 -2.860 1.00 0.73 C ATOM 488 CG HIS A 232 -10.637 -13.080 -4.305 1.00 0.73 C ATOM 489 ND1 HIS A 232 -9.617 -13.061 -5.234 1.00 0.95 N ATOM 490 CD2 HIS A 232 -11.758 -12.734 -4.978 1.00 0.74 C ATOM 491 CE1 HIS A 232 -10.106 -12.717 -6.412 1.00 0.95 C ATOM 492 NE2 HIS A 232 -11.402 -12.513 -6.284 1.00 0.78 N ATOM 0 H HIS A 232 -10.368 -14.238 -0.503 1.00 0.74 H new ATOM 0 HA HIS A 232 -12.056 -14.836 -2.799 1.00 0.73 H new ATOM 0 HB2 HIS A 232 -10.850 -12.618 -2.250 1.00 0.73 H new ATOM 0 HB3 HIS A 232 -9.355 -13.436 -2.658 1.00 0.73 H new ATOM 0 HD2 HIS A 232 -12.751 -12.648 -4.563 1.00 0.74 H new ATOM 0 HE1 HIS A 232 -9.539 -12.619 -7.326 1.00 0.95 H new ATOM 0 HE2 HIS A 232 -12.036 -12.236 -7.033 1.00 0.78 H new ATOM 501 N LYS A 233 -9.681 -16.763 -2.120 1.00 0.80 N ATOM 502 CA LYS A 233 -8.873 -17.893 -2.569 1.00 0.84 C ATOM 503 C LYS A 233 -9.424 -19.221 -2.059 1.00 0.87 C ATOM 504 O LYS A 233 -9.692 -20.130 -2.843 1.00 0.94 O ATOM 505 CB LYS A 233 -7.422 -17.724 -2.112 1.00 0.85 C ATOM 506 CG LYS A 233 -6.443 -17.479 -3.252 1.00 0.83 C ATOM 507 CD LYS A 233 -6.385 -18.663 -4.203 1.00 0.94 C ATOM 508 CE LYS A 233 -5.183 -18.582 -5.128 1.00 1.08 C ATOM 509 NZ LYS A 233 -5.030 -19.814 -5.948 1.00 1.28 N ATOM 0 H LYS A 233 -9.782 -16.687 -1.108 1.00 0.80 H new ATOM 0 HA LYS A 233 -8.912 -17.909 -3.658 1.00 0.84 H new ATOM 0 HB2 LYS A 233 -7.366 -16.890 -1.412 1.00 0.85 H new ATOM 0 HB3 LYS A 233 -7.116 -18.618 -1.568 1.00 0.85 H new ATOM 0 HG2 LYS A 233 -6.739 -16.585 -3.801 1.00 0.83 H new ATOM 0 HG3 LYS A 233 -5.450 -17.289 -2.845 1.00 0.83 H new ATOM 0 HD2 LYS A 233 -6.341 -19.589 -3.629 1.00 0.94 H new ATOM 0 HD3 LYS A 233 -7.299 -18.699 -4.796 1.00 0.94 H new ATOM 0 HE2 LYS A 233 -5.288 -17.719 -5.786 1.00 1.08 H new ATOM 0 HE3 LYS A 233 -4.280 -18.424 -4.538 1.00 1.08 H new ATOM 0 HZ1 LYS A 233 -4.199 -19.719 -6.566 1.00 1.28 H new ATOM 0 HZ2 LYS A 233 -4.904 -20.635 -5.322 1.00 1.28 H new ATOM 0 HZ3 LYS A 233 -5.880 -19.951 -6.531 1.00 1.28 H new ATOM 523 N MET A 234 -9.596 -19.328 -0.749 1.00 0.86 N ATOM 524 CA MET A 234 -10.095 -20.556 -0.138 1.00 0.91 C ATOM 525 C MET A 234 -11.577 -20.763 -0.436 1.00 0.99 C ATOM 526 O MET A 234 -11.970 -21.789 -0.991 1.00 1.09 O ATOM 527 CB MET A 234 -9.868 -20.521 1.376 1.00 0.88 C ATOM 528 CG MET A 234 -9.965 -21.885 2.044 1.00 0.92 C ATOM 529 SD MET A 234 -8.524 -22.922 1.719 1.00 1.07 S ATOM 530 CE MET A 234 -7.237 -22.016 2.579 1.00 1.14 C ATOM 0 H MET A 234 -9.397 -18.579 -0.086 1.00 0.86 H new ATOM 0 HA MET A 234 -9.543 -21.392 -0.568 1.00 0.91 H new ATOM 0 HB2 MET A 234 -8.884 -20.098 1.577 1.00 0.88 H new ATOM 0 HB3 MET A 234 -10.601 -19.852 1.828 1.00 0.88 H new ATOM 0 HG2 MET A 234 -10.076 -21.751 3.120 1.00 0.92 H new ATOM 0 HG3 MET A 234 -10.862 -22.395 1.692 1.00 0.92 H new ATOM 0 HE1 MET A 234 -6.425 -22.695 2.839 1.00 1.14 H new ATOM 0 HE2 MET A 234 -6.856 -21.225 1.934 1.00 1.14 H new ATOM 0 HE3 MET A 234 -7.647 -21.576 3.488 1.00 1.14 H new ATOM 540 N ASN A 235 -12.393 -19.782 -0.077 1.00 0.96 N ATOM 541 CA ASN A 235 -13.834 -19.863 -0.305 1.00 1.04 C ATOM 542 C ASN A 235 -14.149 -19.765 -1.788 1.00 1.06 C ATOM 543 O ASN A 235 -15.105 -20.374 -2.269 1.00 1.20 O ATOM 544 CB ASN A 235 -14.572 -18.759 0.453 1.00 1.02 C ATOM 545 CG ASN A 235 -14.636 -19.013 1.947 1.00 1.15 C ATOM 546 OD1 ASN A 235 -13.660 -19.451 2.555 1.00 1.23 O ATOM 547 ND2 ASN A 235 -15.785 -18.745 2.546 1.00 1.25 N ATOM 0 H ASN A 235 -12.085 -18.920 0.373 1.00 0.96 H new ATOM 0 HA ASN A 235 -14.174 -20.829 0.067 1.00 1.04 H new ATOM 0 HB2 ASN A 235 -14.075 -17.806 0.272 1.00 1.02 H new ATOM 0 HB3 ASN A 235 -15.585 -18.670 0.061 1.00 1.02 H new ATOM 0 HD21 ASN A 235 -15.886 -18.901 3.549 1.00 1.25 H new ATOM 0 HD22 ASN A 235 -16.570 -18.383 2.005 1.00 1.25 H new ATOM 554 N GLY A 236 -13.343 -18.990 -2.505 1.00 0.94 N ATOM 555 CA GLY A 236 -13.540 -18.830 -3.932 1.00 0.98 C ATOM 556 C GLY A 236 -14.652 -17.855 -4.252 1.00 0.98 C ATOM 557 O GLY A 236 -15.306 -17.969 -5.288 1.00 1.09 O ATOM 0 H GLY A 236 -12.555 -18.469 -2.121 1.00 0.94 H new ATOM 0 HA2 GLY A 236 -12.613 -18.483 -4.388 1.00 0.98 H new ATOM 0 HA3 GLY A 236 -13.770 -19.799 -4.376 1.00 0.98 H new ATOM 561 N GLN A 237 -14.868 -16.900 -3.360 1.00 0.90 N ATOM 562 CA GLN A 237 -15.902 -15.896 -3.552 1.00 0.90 C ATOM 563 C GLN A 237 -15.271 -14.563 -3.952 1.00 0.84 C ATOM 564 O GLN A 237 -14.106 -14.524 -4.349 1.00 0.79 O ATOM 565 CB GLN A 237 -16.746 -15.757 -2.283 1.00 0.92 C ATOM 566 CG GLN A 237 -17.788 -16.857 -2.133 1.00 1.05 C ATOM 567 CD GLN A 237 -18.176 -17.109 -0.686 1.00 1.11 C ATOM 568 OE1 GLN A 237 -17.605 -17.974 -0.020 1.00 1.21 O ATOM 569 NE2 GLN A 237 -19.146 -16.358 -0.191 1.00 1.17 N ATOM 0 H GLN A 237 -14.339 -16.800 -2.494 1.00 0.90 H new ATOM 0 HA GLN A 237 -16.563 -16.211 -4.360 1.00 0.90 H new ATOM 0 HB2 GLN A 237 -16.088 -15.767 -1.414 1.00 0.92 H new ATOM 0 HB3 GLN A 237 -17.247 -14.789 -2.292 1.00 0.92 H new ATOM 0 HG2 GLN A 237 -18.678 -16.587 -2.701 1.00 1.05 H new ATOM 0 HG3 GLN A 237 -17.401 -17.779 -2.566 1.00 1.05 H new ATOM 0 HE21 GLN A 237 -19.594 -15.652 -0.776 1.00 1.17 H new ATOM 0 HE22 GLN A 237 -19.446 -16.485 0.776 1.00 1.17 H new ATOM 578 N ASN A 238 -16.035 -13.480 -3.864 1.00 0.87 N ATOM 579 CA ASN A 238 -15.532 -12.161 -4.240 1.00 0.84 C ATOM 580 C ASN A 238 -14.788 -11.514 -3.078 1.00 0.84 C ATOM 581 O ASN A 238 -15.347 -11.494 -1.962 1.00 0.96 O ATOM 582 CB ASN A 238 -16.682 -11.256 -4.691 1.00 0.95 C ATOM 583 CG ASN A 238 -16.197 -10.011 -5.412 1.00 0.91 C ATOM 584 OD1 ASN A 238 -15.266 -10.065 -6.216 1.00 0.93 O ATOM 585 ND2 ASN A 238 -16.825 -8.879 -5.131 1.00 0.96 N ATOM 586 OXT ASN A 238 -13.653 -11.027 -3.289 1.00 0.80 O ATOM 0 H ASN A 238 -17.001 -13.487 -3.537 1.00 0.87 H new ATOM 0 HA ASN A 238 -14.837 -12.290 -5.070 1.00 0.84 H new ATOM 0 HB2 ASN A 238 -17.345 -11.818 -5.349 1.00 0.95 H new ATOM 0 HB3 ASN A 238 -17.270 -10.962 -3.822 1.00 0.95 H new ATOM 0 HD21 ASN A 238 -16.541 -8.012 -5.587 1.00 0.96 H new ATOM 0 HD22 ASN A 238 -17.592 -8.875 -4.459 1.00 0.96 H new ATOM 594 N GLY B 1 -31.501 13.340 -14.954 1.00 1.44 N ATOM 595 CA GLY B 1 -32.414 13.142 -13.805 1.00 1.42 C ATOM 596 C GLY B 1 -32.020 11.942 -12.978 1.00 1.36 C ATOM 597 O GLY B 1 -31.185 11.143 -13.409 1.00 1.36 O ATOM 0 H1 GLY B 1 -30.889 14.162 -14.774 1.00 1.44 H new ATOM 0 H2 GLY B 1 -30.913 12.492 -15.080 1.00 1.44 H new ATOM 0 H3 GLY B 1 -32.059 13.506 -15.816 1.00 1.44 H new ATOM 0 HA2 GLY B 1 -32.408 14.034 -13.178 1.00 1.42 H new ATOM 0 HA3 GLY B 1 -33.434 13.014 -14.168 1.00 1.42 H new ATOM 603 N SER B 2 -32.628 11.813 -11.798 1.00 1.35 N ATOM 604 CA SER B 2 -32.349 10.709 -10.885 1.00 1.32 C ATOM 605 C SER B 2 -30.898 10.763 -10.403 1.00 1.29 C ATOM 606 O SER B 2 -30.202 11.761 -10.620 1.00 1.34 O ATOM 607 CB SER B 2 -32.649 9.369 -11.561 1.00 1.32 C ATOM 608 OG SER B 2 -33.943 9.375 -12.144 1.00 1.35 O ATOM 0 H SER B 2 -33.326 12.471 -11.451 1.00 1.35 H new ATOM 0 HA SER B 2 -32.998 10.806 -10.015 1.00 1.32 H new ATOM 0 HB2 SER B 2 -31.901 9.168 -12.328 1.00 1.32 H new ATOM 0 HB3 SER B 2 -32.579 8.564 -10.829 1.00 1.32 H new ATOM 0 HG SER B 2 -34.113 8.510 -12.572 1.00 1.35 H new ATOM 614 N LEU B 3 -30.453 9.715 -9.725 1.00 1.26 N ATOM 615 CA LEU B 3 -29.088 9.664 -9.225 1.00 1.24 C ATOM 616 C LEU B 3 -28.124 9.334 -10.358 1.00 1.23 C ATOM 617 O LEU B 3 -27.339 10.187 -10.777 1.00 1.22 O ATOM 618 CB LEU B 3 -28.965 8.629 -8.103 1.00 1.26 C ATOM 619 CG LEU B 3 -27.600 8.568 -7.416 1.00 1.27 C ATOM 620 CD1 LEU B 3 -27.365 9.822 -6.585 1.00 1.23 C ATOM 621 CD2 LEU B 3 -27.495 7.323 -6.547 1.00 1.39 C ATOM 0 H LEU B 3 -31.015 8.892 -9.509 1.00 1.26 H new ATOM 0 HA LEU B 3 -28.831 10.643 -8.820 1.00 1.24 H new ATOM 0 HB2 LEU B 3 -29.723 8.843 -7.350 1.00 1.26 H new ATOM 0 HB3 LEU B 3 -29.191 7.645 -8.513 1.00 1.26 H new ATOM 0 HG LEU B 3 -26.829 8.516 -8.185 1.00 1.27 H new ATOM 0 HD11 LEU B 3 -26.389 9.762 -6.103 1.00 1.23 H new ATOM 0 HD12 LEU B 3 -27.397 10.699 -7.232 1.00 1.23 H new ATOM 0 HD13 LEU B 3 -28.141 9.905 -5.824 1.00 1.23 H new ATOM 0 HD21 LEU B 3 -26.517 7.296 -6.066 1.00 1.39 H new ATOM 0 HD22 LEU B 3 -28.274 7.345 -5.785 1.00 1.39 H new ATOM 0 HD23 LEU B 3 -27.619 6.435 -7.167 1.00 1.39 H new ATOM 633 N LEU B 4 -28.199 8.089 -10.838 1.00 1.27 N ATOM 634 CA LEU B 4 -27.354 7.588 -11.929 1.00 1.29 C ATOM 635 C LEU B 4 -25.895 7.436 -11.498 1.00 1.24 C ATOM 636 O LEU B 4 -25.271 6.408 -11.754 1.00 1.22 O ATOM 637 CB LEU B 4 -27.452 8.486 -13.169 1.00 1.32 C ATOM 638 CG LEU B 4 -28.329 7.940 -14.301 1.00 1.42 C ATOM 639 CD1 LEU B 4 -27.821 6.581 -14.760 1.00 1.54 C ATOM 640 CD2 LEU B 4 -29.782 7.841 -13.857 1.00 1.42 C ATOM 0 H LEU B 4 -28.853 7.394 -10.478 1.00 1.27 H new ATOM 0 HA LEU B 4 -27.731 6.599 -12.188 1.00 1.29 H new ATOM 0 HB2 LEU B 4 -27.842 9.457 -12.865 1.00 1.32 H new ATOM 0 HB3 LEU B 4 -26.447 8.653 -13.557 1.00 1.32 H new ATOM 0 HG LEU B 4 -28.273 8.633 -15.140 1.00 1.42 H new ATOM 0 HD11 LEU B 4 -28.455 6.208 -15.564 1.00 1.54 H new ATOM 0 HD12 LEU B 4 -26.797 6.678 -15.121 1.00 1.54 H new ATOM 0 HD13 LEU B 4 -27.846 5.882 -13.924 1.00 1.54 H new ATOM 0 HD21 LEU B 4 -30.387 7.451 -14.676 1.00 1.42 H new ATOM 0 HD22 LEU B 4 -29.856 7.171 -13.000 1.00 1.42 H new ATOM 0 HD23 LEU B 4 -30.145 8.830 -13.577 1.00 1.42 H new ATOM 652 N LYS B 5 -25.353 8.455 -10.853 1.00 1.25 N ATOM 653 CA LYS B 5 -23.978 8.426 -10.389 1.00 1.22 C ATOM 654 C LYS B 5 -23.942 8.134 -8.894 1.00 1.16 C ATOM 655 O LYS B 5 -24.351 8.968 -8.086 1.00 1.27 O ATOM 656 CB LYS B 5 -23.287 9.761 -10.684 1.00 1.38 C ATOM 657 CG LYS B 5 -23.335 10.166 -12.151 1.00 1.49 C ATOM 658 CD LYS B 5 -22.633 9.151 -13.038 1.00 1.59 C ATOM 659 CE LYS B 5 -22.558 9.631 -14.478 1.00 1.88 C ATOM 660 NZ LYS B 5 -21.678 8.766 -15.307 1.00 2.01 N ATOM 0 H LYS B 5 -25.850 9.319 -10.638 1.00 1.25 H new ATOM 0 HA LYS B 5 -23.445 7.636 -10.918 1.00 1.22 H new ATOM 0 HB2 LYS B 5 -23.756 10.542 -10.085 1.00 1.38 H new ATOM 0 HB3 LYS B 5 -22.246 9.698 -10.368 1.00 1.38 H new ATOM 0 HG2 LYS B 5 -24.373 10.268 -12.466 1.00 1.49 H new ATOM 0 HG3 LYS B 5 -22.867 11.143 -12.274 1.00 1.49 H new ATOM 0 HD2 LYS B 5 -21.627 8.970 -12.660 1.00 1.59 H new ATOM 0 HD3 LYS B 5 -23.165 8.200 -12.997 1.00 1.59 H new ATOM 0 HE2 LYS B 5 -23.560 9.647 -14.908 1.00 1.88 H new ATOM 0 HE3 LYS B 5 -22.185 10.655 -14.500 1.00 1.88 H new ATOM 0 HZ1 LYS B 5 -21.654 9.128 -16.282 1.00 2.01 H new ATOM 0 HZ2 LYS B 5 -20.716 8.770 -14.913 1.00 2.01 H new ATOM 0 HZ3 LYS B 5 -22.048 7.794 -15.307 1.00 2.01 H new ATOM 674 N PRO B 6 -23.456 6.944 -8.507 1.00 1.02 N ATOM 675 CA PRO B 6 -23.378 6.538 -7.102 1.00 1.00 C ATOM 676 C PRO B 6 -22.221 7.209 -6.363 1.00 1.02 C ATOM 677 O PRO B 6 -21.258 6.556 -5.961 1.00 1.01 O ATOM 678 CB PRO B 6 -23.167 5.026 -7.189 1.00 0.90 C ATOM 679 CG PRO B 6 -22.465 4.811 -8.488 1.00 0.86 C ATOM 680 CD PRO B 6 -22.931 5.902 -9.413 1.00 0.95 C ATOM 0 HA PRO B 6 -24.267 6.826 -6.540 1.00 1.00 H new ATOM 0 HB2 PRO B 6 -22.571 4.661 -6.353 1.00 0.90 H new ATOM 0 HB3 PRO B 6 -24.117 4.492 -7.160 1.00 0.90 H new ATOM 0 HG2 PRO B 6 -21.384 4.851 -8.356 1.00 0.86 H new ATOM 0 HG3 PRO B 6 -22.700 3.829 -8.898 1.00 0.86 H new ATOM 0 HD2 PRO B 6 -22.113 6.282 -10.025 1.00 0.95 H new ATOM 0 HD3 PRO B 6 -23.701 5.543 -10.096 1.00 0.95 H new ATOM 688 N ALA B 7 -22.321 8.521 -6.188 1.00 1.11 N ATOM 689 CA ALA B 7 -21.294 9.285 -5.493 1.00 1.15 C ATOM 690 C ALA B 7 -21.434 9.126 -3.981 1.00 1.14 C ATOM 691 O ALA B 7 -21.681 10.090 -3.253 1.00 1.22 O ATOM 692 CB ALA B 7 -21.368 10.753 -5.891 1.00 1.26 C ATOM 0 H ALA B 7 -23.107 9.080 -6.520 1.00 1.11 H new ATOM 0 HA ALA B 7 -20.318 8.898 -5.784 1.00 1.15 H new ATOM 0 HB1 ALA B 7 -20.595 11.312 -5.364 1.00 1.26 H new ATOM 0 HB2 ALA B 7 -21.215 10.847 -6.966 1.00 1.26 H new ATOM 0 HB3 ALA B 7 -22.348 11.152 -5.628 1.00 1.26 H new ATOM 698 N ARG B 8 -21.296 7.893 -3.518 1.00 1.08 N ATOM 699 CA ARG B 8 -21.404 7.584 -2.103 1.00 1.08 C ATOM 700 C ARG B 8 -20.401 6.506 -1.725 1.00 1.01 C ATOM 701 O ARG B 8 -20.382 5.436 -2.326 1.00 1.02 O ATOM 702 CB ARG B 8 -22.819 7.113 -1.754 1.00 1.12 C ATOM 703 CG ARG B 8 -23.858 8.226 -1.743 1.00 1.21 C ATOM 704 CD ARG B 8 -23.504 9.312 -0.739 1.00 1.25 C ATOM 705 NE ARG B 8 -24.594 10.268 -0.546 1.00 1.41 N ATOM 706 CZ ARG B 8 -24.598 11.510 -1.038 1.00 1.46 C ATOM 707 NH1 ARG B 8 -23.618 11.926 -1.834 1.00 1.66 N ATOM 708 NH2 ARG B 8 -25.600 12.329 -0.755 1.00 1.61 N ATOM 0 H ARG B 8 -21.107 7.084 -4.110 1.00 1.08 H new ATOM 0 HA ARG B 8 -21.190 8.493 -1.540 1.00 1.08 H new ATOM 0 HB2 ARG B 8 -23.125 6.352 -2.472 1.00 1.12 H new ATOM 0 HB3 ARG B 8 -22.801 6.637 -0.773 1.00 1.12 H new ATOM 0 HG2 ARG B 8 -23.936 8.662 -2.739 1.00 1.21 H new ATOM 0 HG3 ARG B 8 -24.836 7.810 -1.500 1.00 1.21 H new ATOM 0 HD2 ARG B 8 -23.254 8.852 0.217 1.00 1.25 H new ATOM 0 HD3 ARG B 8 -22.615 9.842 -1.080 1.00 1.25 H new ATOM 0 HE ARG B 8 -25.402 9.967 -0.001 1.00 1.41 H new ATOM 0 HH11 ARG B 8 -22.854 11.295 -2.074 1.00 1.66 H new ATOM 0 HH12 ARG B 8 -23.630 12.876 -2.204 1.00 1.66 H new ATOM 0 HH21 ARG B 8 -26.367 12.011 -0.162 1.00 1.61 H new ATOM 0 HH22 ARG B 8 -25.605 13.278 -1.130 1.00 1.61 H new ATOM 722 N PHE B 9 -19.566 6.800 -0.739 1.00 0.97 N ATOM 723 CA PHE B 9 -18.561 5.849 -0.275 1.00 0.91 C ATOM 724 C PHE B 9 -18.793 5.520 1.194 1.00 0.91 C ATOM 725 O PHE B 9 -17.906 5.019 1.887 1.00 0.86 O ATOM 726 CB PHE B 9 -17.150 6.416 -0.480 1.00 0.88 C ATOM 727 CG PHE B 9 -16.963 7.816 0.043 1.00 0.93 C ATOM 728 CD1 PHE B 9 -17.209 8.912 -0.769 1.00 1.04 C ATOM 729 CD2 PHE B 9 -16.533 8.034 1.341 1.00 0.91 C ATOM 730 CE1 PHE B 9 -17.033 10.198 -0.295 1.00 1.11 C ATOM 731 CE2 PHE B 9 -16.355 9.316 1.821 1.00 0.98 C ATOM 732 CZ PHE B 9 -16.604 10.400 1.003 1.00 1.07 C ATOM 0 H PHE B 9 -19.563 7.691 -0.243 1.00 0.97 H new ATOM 0 HA PHE B 9 -18.650 4.933 -0.859 1.00 0.91 H new ATOM 0 HB2 PHE B 9 -16.432 5.759 0.010 1.00 0.88 H new ATOM 0 HB3 PHE B 9 -16.917 6.404 -1.545 1.00 0.88 H new ATOM 0 HD1 PHE B 9 -17.542 8.759 -1.785 1.00 1.04 H new ATOM 0 HD2 PHE B 9 -16.334 7.191 1.986 1.00 0.91 H new ATOM 0 HE1 PHE B 9 -17.230 11.043 -0.938 1.00 1.11 H new ATOM 0 HE2 PHE B 9 -16.021 9.471 2.836 1.00 0.98 H new ATOM 0 HZ PHE B 9 -16.464 11.404 1.377 1.00 1.07 H new ATOM 742 N MET B 10 -20.002 5.803 1.655 1.00 0.97 N ATOM 743 CA MET B 10 -20.372 5.564 3.041 1.00 0.98 C ATOM 744 C MET B 10 -21.856 5.241 3.143 1.00 1.04 C ATOM 745 O MET B 10 -22.701 6.071 2.808 1.00 1.11 O ATOM 746 CB MET B 10 -20.051 6.799 3.893 1.00 1.00 C ATOM 747 CG MET B 10 -20.559 6.715 5.326 1.00 1.02 C ATOM 748 SD MET B 10 -20.454 8.296 6.187 1.00 1.08 S ATOM 749 CE MET B 10 -21.286 7.898 7.720 1.00 1.12 C ATOM 0 H MET B 10 -20.748 6.201 1.085 1.00 0.97 H new ATOM 0 HA MET B 10 -19.798 4.715 3.412 1.00 0.98 H new ATOM 0 HB2 MET B 10 -18.971 6.945 3.910 1.00 1.00 H new ATOM 0 HB3 MET B 10 -20.484 7.678 3.416 1.00 1.00 H new ATOM 0 HG2 MET B 10 -21.595 6.375 5.322 1.00 1.02 H new ATOM 0 HG3 MET B 10 -19.980 5.969 5.870 1.00 1.02 H new ATOM 0 HE1 MET B 10 -21.666 8.812 8.176 1.00 1.12 H new ATOM 0 HE2 MET B 10 -22.116 7.221 7.518 1.00 1.12 H new ATOM 0 HE3 MET B 10 -20.584 7.418 8.401 1.00 1.12 H new ATOM 759 N CYS B 11 -22.168 4.030 3.583 1.00 1.04 N ATOM 760 CA CYS B 11 -23.549 3.613 3.730 1.00 1.11 C ATOM 761 C CYS B 11 -24.126 4.126 5.038 1.00 1.17 C ATOM 762 O CYS B 11 -23.398 4.319 6.016 1.00 1.16 O ATOM 763 CB CYS B 11 -23.635 2.094 3.691 1.00 1.10 C ATOM 764 SG CYS B 11 -22.379 1.332 2.620 1.00 1.02 S ATOM 0 H CYS B 11 -21.482 3.322 3.843 1.00 1.04 H new ATOM 0 HA CYS B 11 -24.128 4.031 2.906 1.00 1.11 H new ATOM 0 HB2 CYS B 11 -23.525 1.704 4.703 1.00 1.10 H new ATOM 0 HB3 CYS B 11 -24.626 1.802 3.343 1.00 1.10 H new ATOM 0 HG CYS B 11 -22.611 0.057 2.519 1.00 1.02 H new ATOM 769 N LEU B 12 -25.431 4.332 5.045 1.00 1.24 N ATOM 770 CA LEU B 12 -26.126 4.805 6.232 1.00 1.32 C ATOM 771 C LEU B 12 -26.031 3.787 7.385 1.00 1.31 C ATOM 772 O LEU B 12 -25.744 4.176 8.517 1.00 1.34 O ATOM 773 CB LEU B 12 -27.595 5.130 5.914 1.00 1.42 C ATOM 774 CG LEU B 12 -27.842 6.504 5.281 1.00 1.51 C ATOM 775 CD1 LEU B 12 -27.325 6.553 3.854 1.00 1.49 C ATOM 776 CD2 LEU B 12 -29.321 6.852 5.320 1.00 1.64 C ATOM 0 H LEU B 12 -26.035 4.178 4.238 1.00 1.24 H new ATOM 0 HA LEU B 12 -25.634 5.722 6.557 1.00 1.32 H new ATOM 0 HB2 LEU B 12 -27.982 4.364 5.242 1.00 1.42 H new ATOM 0 HB3 LEU B 12 -28.172 5.065 6.837 1.00 1.42 H new ATOM 0 HG LEU B 12 -27.293 7.243 5.864 1.00 1.51 H new ATOM 0 HD11 LEU B 12 -27.515 7.540 3.432 1.00 1.49 H new ATOM 0 HD12 LEU B 12 -26.253 6.356 3.848 1.00 1.49 H new ATOM 0 HD13 LEU B 12 -27.836 5.798 3.256 1.00 1.49 H new ATOM 0 HD21 LEU B 12 -29.477 7.831 4.866 1.00 1.64 H new ATOM 0 HD22 LEU B 12 -29.886 6.102 4.767 1.00 1.64 H new ATOM 0 HD23 LEU B 12 -29.663 6.873 6.355 1.00 1.64 H new ATOM 788 N PRO B 13 -26.283 2.475 7.138 1.00 1.30 N ATOM 789 CA PRO B 13 -26.187 1.453 8.189 1.00 1.30 C ATOM 790 C PRO B 13 -24.746 1.212 8.636 1.00 1.22 C ATOM 791 O PRO B 13 -24.459 1.172 9.833 1.00 1.28 O ATOM 792 CB PRO B 13 -26.758 0.185 7.536 1.00 1.31 C ATOM 793 CG PRO B 13 -27.451 0.650 6.304 1.00 1.34 C ATOM 794 CD PRO B 13 -26.716 1.879 5.862 1.00 1.29 C ATOM 0 HA PRO B 13 -26.723 1.758 9.088 1.00 1.30 H new ATOM 0 HB2 PRO B 13 -25.966 -0.524 7.297 1.00 1.31 H new ATOM 0 HB3 PRO B 13 -27.450 -0.325 8.207 1.00 1.31 H new ATOM 0 HG2 PRO B 13 -27.430 -0.118 5.530 1.00 1.34 H new ATOM 0 HG3 PRO B 13 -28.499 0.872 6.505 1.00 1.34 H new ATOM 0 HD2 PRO B 13 -25.869 1.635 5.221 1.00 1.29 H new ATOM 0 HD3 PRO B 13 -27.359 2.554 5.297 1.00 1.29 H new ATOM 802 N CYS B 14 -23.845 1.059 7.667 1.00 1.09 N ATOM 803 CA CYS B 14 -22.438 0.817 7.957 1.00 1.00 C ATOM 804 C CYS B 14 -21.814 1.989 8.710 1.00 1.04 C ATOM 805 O CYS B 14 -21.258 1.813 9.795 1.00 1.06 O ATOM 806 CB CYS B 14 -21.684 0.539 6.656 1.00 0.92 C ATOM 807 SG CYS B 14 -22.339 -0.894 5.743 1.00 1.03 S ATOM 0 H CYS B 14 -24.068 1.099 6.672 1.00 1.09 H new ATOM 0 HA CYS B 14 -22.364 -0.057 8.604 1.00 1.00 H new ATOM 0 HB2 CYS B 14 -21.733 1.422 6.019 1.00 0.92 H new ATOM 0 HB3 CYS B 14 -20.632 0.368 6.882 1.00 0.92 H new ATOM 0 HG CYS B 14 -22.550 -0.560 4.504 1.00 1.03 H new ATOM 812 N GLY B 15 -21.905 3.177 8.132 1.00 1.07 N ATOM 813 CA GLY B 15 -21.350 4.358 8.766 1.00 1.11 C ATOM 814 C GLY B 15 -19.856 4.498 8.543 1.00 1.01 C ATOM 815 O GLY B 15 -19.262 5.519 8.890 1.00 1.04 O ATOM 0 H GLY B 15 -22.355 3.346 7.232 1.00 1.07 H new ATOM 0 HA2 GLY B 15 -21.855 5.243 8.380 1.00 1.11 H new ATOM 0 HA3 GLY B 15 -21.551 4.318 9.837 1.00 1.11 H new ATOM 819 N ILE B 16 -19.253 3.480 7.951 1.00 0.95 N ATOM 820 CA ILE B 16 -17.824 3.484 7.683 1.00 0.87 C ATOM 821 C ILE B 16 -17.548 3.990 6.274 1.00 0.83 C ATOM 822 O ILE B 16 -17.923 3.354 5.287 1.00 0.84 O ATOM 823 CB ILE B 16 -17.209 2.079 7.857 1.00 0.85 C ATOM 824 CG1 ILE B 16 -17.513 1.539 9.258 1.00 0.94 C ATOM 825 CG2 ILE B 16 -15.705 2.124 7.613 1.00 0.77 C ATOM 826 CD1 ILE B 16 -17.044 0.118 9.485 1.00 1.06 C ATOM 0 H ILE B 16 -19.735 2.635 7.645 1.00 0.95 H new ATOM 0 HA ILE B 16 -17.359 4.153 8.407 1.00 0.87 H new ATOM 0 HB ILE B 16 -17.655 1.407 7.123 1.00 0.85 H new ATOM 0 HG12 ILE B 16 -17.043 2.188 9.996 1.00 0.94 H new ATOM 0 HG13 ILE B 16 -18.588 1.588 9.430 1.00 0.94 H new ATOM 0 HG21 ILE B 16 -15.286 1.126 7.739 1.00 0.77 H new ATOM 0 HG22 ILE B 16 -15.511 2.473 6.599 1.00 0.77 H new ATOM 0 HG23 ILE B 16 -15.241 2.805 8.326 1.00 0.77 H new ATOM 0 HD11 ILE B 16 -17.296 -0.191 10.500 1.00 1.06 H new ATOM 0 HD12 ILE B 16 -17.534 -0.545 8.772 1.00 1.06 H new ATOM 0 HD13 ILE B 16 -15.964 0.065 9.347 1.00 1.06 H new ATOM 838 N ALA B 17 -16.906 5.146 6.195 1.00 0.84 N ATOM 839 CA ALA B 17 -16.570 5.749 4.919 1.00 0.83 C ATOM 840 C ALA B 17 -15.274 5.159 4.379 1.00 0.75 C ATOM 841 O ALA B 17 -14.251 5.155 5.065 1.00 0.76 O ATOM 842 CB ALA B 17 -16.447 7.261 5.064 1.00 0.89 C ATOM 0 H ALA B 17 -16.607 5.686 7.007 1.00 0.84 H new ATOM 0 HA ALA B 17 -17.370 5.533 4.211 1.00 0.83 H new ATOM 0 HB1 ALA B 17 -16.195 7.700 4.099 1.00 0.89 H new ATOM 0 HB2 ALA B 17 -17.395 7.671 5.412 1.00 0.89 H new ATOM 0 HB3 ALA B 17 -15.664 7.495 5.785 1.00 0.89 H new ATOM 848 N PHE B 18 -15.324 4.659 3.155 1.00 0.70 N ATOM 849 CA PHE B 18 -14.153 4.065 2.525 1.00 0.63 C ATOM 850 C PHE B 18 -13.353 5.124 1.776 1.00 0.64 C ATOM 851 O PHE B 18 -13.657 6.318 1.860 1.00 0.72 O ATOM 852 CB PHE B 18 -14.573 2.936 1.581 1.00 0.59 C ATOM 853 CG PHE B 18 -14.596 1.582 2.239 1.00 0.56 C ATOM 854 CD1 PHE B 18 -14.775 1.462 3.610 1.00 0.60 C ATOM 855 CD2 PHE B 18 -14.428 0.432 1.488 1.00 0.52 C ATOM 856 CE1 PHE B 18 -14.790 0.222 4.216 1.00 0.60 C ATOM 857 CE2 PHE B 18 -14.440 -0.811 2.089 1.00 0.53 C ATOM 858 CZ PHE B 18 -14.623 -0.915 3.454 1.00 0.56 C ATOM 0 H PHE B 18 -16.164 4.652 2.576 1.00 0.70 H new ATOM 0 HA PHE B 18 -13.516 3.645 3.303 1.00 0.63 H new ATOM 0 HB2 PHE B 18 -15.564 3.155 1.183 1.00 0.59 H new ATOM 0 HB3 PHE B 18 -13.888 2.908 0.733 1.00 0.59 H new ATOM 0 HD1 PHE B 18 -14.904 2.350 4.210 1.00 0.60 H new ATOM 0 HD2 PHE B 18 -14.286 0.508 0.420 1.00 0.52 H new ATOM 0 HE1 PHE B 18 -14.932 0.143 5.284 1.00 0.60 H new ATOM 0 HE2 PHE B 18 -14.306 -1.701 1.492 1.00 0.53 H new ATOM 0 HZ PHE B 18 -14.635 -1.887 3.925 1.00 0.56 H new ATOM 868 N SER B 19 -12.324 4.695 1.062 1.00 0.59 N ATOM 869 CA SER B 19 -11.487 5.617 0.310 1.00 0.60 C ATOM 870 C SER B 19 -11.314 5.145 -1.132 1.00 0.57 C ATOM 871 O SER B 19 -11.301 5.954 -2.061 1.00 0.60 O ATOM 872 CB SER B 19 -10.124 5.753 0.991 1.00 0.60 C ATOM 873 OG SER B 19 -10.280 5.959 2.385 1.00 0.68 O ATOM 0 H SER B 19 -12.049 3.716 0.987 1.00 0.59 H new ATOM 0 HA SER B 19 -11.976 6.591 0.290 1.00 0.60 H new ATOM 0 HB2 SER B 19 -9.532 4.855 0.815 1.00 0.60 H new ATOM 0 HB3 SER B 19 -9.575 6.587 0.554 1.00 0.60 H new ATOM 0 HG SER B 19 -9.398 6.042 2.804 1.00 0.68 H new ATOM 879 N SER B 20 -11.196 3.835 -1.312 1.00 0.52 N ATOM 880 CA SER B 20 -11.018 3.260 -2.634 1.00 0.51 C ATOM 881 C SER B 20 -12.325 2.642 -3.138 1.00 0.52 C ATOM 882 O SER B 20 -13.036 1.972 -2.391 1.00 0.54 O ATOM 883 CB SER B 20 -9.910 2.203 -2.595 1.00 0.45 C ATOM 884 OG SER B 20 -8.844 2.613 -1.752 1.00 0.44 O ATOM 0 H SER B 20 -11.221 3.152 -0.555 1.00 0.52 H new ATOM 0 HA SER B 20 -10.730 4.054 -3.324 1.00 0.51 H new ATOM 0 HB2 SER B 20 -10.317 1.257 -2.238 1.00 0.45 H new ATOM 0 HB3 SER B 20 -9.534 2.028 -3.603 1.00 0.45 H new ATOM 0 HG SER B 20 -8.985 2.258 -0.850 1.00 0.44 H new ATOM 890 N PRO B 21 -12.671 2.874 -4.415 1.00 0.54 N ATOM 891 CA PRO B 21 -13.895 2.327 -5.009 1.00 0.56 C ATOM 892 C PRO B 21 -13.820 0.811 -5.177 1.00 0.52 C ATOM 893 O PRO B 21 -14.838 0.119 -5.147 1.00 0.54 O ATOM 894 CB PRO B 21 -13.967 3.016 -6.373 1.00 0.62 C ATOM 895 CG PRO B 21 -12.559 3.384 -6.692 1.00 0.61 C ATOM 896 CD PRO B 21 -11.903 3.691 -5.374 1.00 0.58 C ATOM 0 HA PRO B 21 -14.771 2.504 -4.385 1.00 0.56 H new ATOM 0 HB2 PRO B 21 -14.383 2.351 -7.130 1.00 0.62 H new ATOM 0 HB3 PRO B 21 -14.607 3.897 -6.337 1.00 0.62 H new ATOM 0 HG2 PRO B 21 -12.048 2.567 -7.201 1.00 0.61 H new ATOM 0 HG3 PRO B 21 -12.522 4.247 -7.357 1.00 0.61 H new ATOM 0 HD2 PRO B 21 -10.847 3.421 -5.378 1.00 0.58 H new ATOM 0 HD3 PRO B 21 -11.960 4.753 -5.134 1.00 0.58 H new ATOM 904 N SER B 22 -12.606 0.308 -5.349 1.00 0.49 N ATOM 905 CA SER B 22 -12.369 -1.114 -5.525 1.00 0.47 C ATOM 906 C SER B 22 -12.749 -1.897 -4.270 1.00 0.46 C ATOM 907 O SER B 22 -13.270 -3.012 -4.347 1.00 0.48 O ATOM 908 CB SER B 22 -10.900 -1.330 -5.864 1.00 0.47 C ATOM 909 OG SER B 22 -10.365 -0.182 -6.502 1.00 0.48 O ATOM 0 H SER B 22 -11.759 0.876 -5.370 1.00 0.49 H new ATOM 0 HA SER B 22 -12.994 -1.481 -6.339 1.00 0.47 H new ATOM 0 HB2 SER B 22 -10.338 -1.543 -4.955 1.00 0.47 H new ATOM 0 HB3 SER B 22 -10.794 -2.198 -6.515 1.00 0.47 H new ATOM 0 HG SER B 22 -9.932 0.391 -5.835 1.00 0.48 H new ATOM 915 N THR B 23 -12.495 -1.303 -3.114 1.00 0.45 N ATOM 916 CA THR B 23 -12.814 -1.931 -1.848 1.00 0.46 C ATOM 917 C THR B 23 -14.309 -1.835 -1.566 1.00 0.51 C ATOM 918 O THR B 23 -14.892 -2.707 -0.921 1.00 0.54 O ATOM 919 CB THR B 23 -12.027 -1.271 -0.705 1.00 0.44 C ATOM 920 OG1 THR B 23 -11.357 -0.101 -1.191 1.00 0.56 O ATOM 921 CG2 THR B 23 -11.011 -2.235 -0.121 1.00 0.41 C ATOM 0 H THR B 23 -12.066 -0.381 -3.030 1.00 0.45 H new ATOM 0 HA THR B 23 -12.532 -2.982 -1.910 1.00 0.46 H new ATOM 0 HB THR B 23 -12.730 -0.992 0.080 1.00 0.44 H new ATOM 0 HG1 THR B 23 -11.471 0.631 -0.550 1.00 0.56 H new ATOM 0 HG21 THR B 23 -10.467 -1.745 0.686 1.00 0.41 H new ATOM 0 HG22 THR B 23 -11.525 -3.113 0.269 1.00 0.41 H new ATOM 0 HG23 THR B 23 -10.310 -2.540 -0.898 1.00 0.41 H new ATOM 929 N LEU B 24 -14.928 -0.781 -2.083 1.00 0.53 N ATOM 930 CA LEU B 24 -16.352 -0.554 -1.892 1.00 0.59 C ATOM 931 C LEU B 24 -17.184 -1.569 -2.675 1.00 0.60 C ATOM 932 O LEU B 24 -18.297 -1.907 -2.270 1.00 0.65 O ATOM 933 CB LEU B 24 -16.721 0.867 -2.319 1.00 0.61 C ATOM 934 CG LEU B 24 -18.107 1.344 -1.878 1.00 0.66 C ATOM 935 CD1 LEU B 24 -18.153 1.551 -0.370 1.00 0.70 C ATOM 936 CD2 LEU B 24 -18.483 2.627 -2.601 1.00 0.69 C ATOM 0 H LEU B 24 -14.461 -0.066 -2.641 1.00 0.53 H new ATOM 0 HA LEU B 24 -16.574 -0.679 -0.832 1.00 0.59 H new ATOM 0 HB2 LEU B 24 -15.975 1.554 -1.920 1.00 0.61 H new ATOM 0 HB3 LEU B 24 -16.662 0.929 -3.406 1.00 0.61 H new ATOM 0 HG LEU B 24 -18.832 0.573 -2.139 1.00 0.66 H new ATOM 0 HD11 LEU B 24 -19.147 1.890 -0.079 1.00 0.70 H new ATOM 0 HD12 LEU B 24 -17.929 0.611 0.133 1.00 0.70 H new ATOM 0 HD13 LEU B 24 -17.416 2.301 -0.083 1.00 0.70 H new ATOM 0 HD21 LEU B 24 -19.471 2.952 -2.275 1.00 0.69 H new ATOM 0 HD22 LEU B 24 -17.752 3.402 -2.371 1.00 0.69 H new ATOM 0 HD23 LEU B 24 -18.496 2.448 -3.676 1.00 0.69 H new ATOM 948 N GLU B 25 -16.632 -2.052 -3.788 1.00 0.58 N ATOM 949 CA GLU B 25 -17.317 -3.026 -4.640 1.00 0.60 C ATOM 950 C GLU B 25 -17.721 -4.270 -3.850 1.00 0.60 C ATOM 951 O GLU B 25 -18.903 -4.600 -3.761 1.00 0.62 O ATOM 952 CB GLU B 25 -16.420 -3.416 -5.821 1.00 0.60 C ATOM 953 CG GLU B 25 -17.085 -4.345 -6.833 1.00 0.63 C ATOM 954 CD GLU B 25 -16.570 -5.773 -6.755 1.00 0.83 C ATOM 955 OE1 GLU B 25 -15.726 -6.065 -5.884 1.00 1.15 O ATOM 956 OE2 GLU B 25 -17.008 -6.616 -7.568 1.00 1.25 O ATOM 0 H GLU B 25 -15.707 -1.783 -4.123 1.00 0.58 H new ATOM 0 HA GLU B 25 -18.227 -2.561 -5.019 1.00 0.60 H new ATOM 0 HB2 GLU B 25 -16.099 -2.509 -6.334 1.00 0.60 H new ATOM 0 HB3 GLU B 25 -15.522 -3.900 -5.436 1.00 0.60 H new ATOM 0 HG2 GLU B 25 -18.162 -4.343 -6.667 1.00 0.63 H new ATOM 0 HG3 GLU B 25 -16.917 -3.958 -7.838 1.00 0.63 H new ATOM 963 N ALA B 26 -16.739 -4.947 -3.269 1.00 0.61 N ATOM 964 CA ALA B 26 -17.002 -6.155 -2.495 1.00 0.64 C ATOM 965 C ALA B 26 -17.615 -5.811 -1.145 1.00 0.67 C ATOM 966 O ALA B 26 -18.244 -6.653 -0.503 1.00 0.72 O ATOM 967 CB ALA B 26 -15.730 -6.962 -2.323 1.00 0.66 C ATOM 0 H ALA B 26 -15.755 -4.682 -3.318 1.00 0.61 H new ATOM 0 HA ALA B 26 -17.721 -6.764 -3.043 1.00 0.64 H new ATOM 0 HB1 ALA B 26 -15.944 -7.860 -1.743 1.00 0.66 H new ATOM 0 HB2 ALA B 26 -15.344 -7.246 -3.302 1.00 0.66 H new ATOM 0 HB3 ALA B 26 -14.986 -6.361 -1.800 1.00 0.66 H new ATOM 973 N HIS B 27 -17.423 -4.568 -0.712 1.00 0.67 N ATOM 974 CA HIS B 27 -17.986 -4.110 0.549 1.00 0.71 C ATOM 975 C HIS B 27 -19.504 -4.258 0.490 1.00 0.75 C ATOM 976 O HIS B 27 -20.132 -4.730 1.441 1.00 0.80 O ATOM 977 CB HIS B 27 -17.581 -2.639 0.826 1.00 0.71 C ATOM 978 CG HIS B 27 -18.406 -1.926 1.873 1.00 0.76 C ATOM 979 ND1 HIS B 27 -17.867 -1.297 2.990 1.00 0.78 N ATOM 980 CD2 HIS B 27 -19.741 -1.759 1.971 1.00 0.81 C ATOM 981 CE1 HIS B 27 -18.856 -0.783 3.721 1.00 0.84 C ATOM 982 NE2 HIS B 27 -19.983 -1.064 3.108 1.00 0.85 N ATOM 0 H HIS B 27 -16.883 -3.864 -1.216 1.00 0.67 H new ATOM 0 HA HIS B 27 -17.596 -4.715 1.368 1.00 0.71 H new ATOM 0 HB2 HIS B 27 -16.536 -2.620 1.136 1.00 0.71 H new ATOM 0 HB3 HIS B 27 -17.647 -2.080 -0.107 1.00 0.71 H new ATOM 0 HD1 HIS B 27 -16.874 -1.238 3.214 1.00 0.78 H new ATOM 0 HD2 HIS B 27 -20.482 -2.115 1.270 1.00 0.81 H new ATOM 0 HE1 HIS B 27 -18.750 -0.236 4.646 1.00 0.84 H new ATOM 990 N GLN B 28 -20.080 -3.855 -0.639 1.00 0.75 N ATOM 991 CA GLN B 28 -21.523 -3.915 -0.839 1.00 0.81 C ATOM 992 C GLN B 28 -21.970 -5.347 -1.123 1.00 0.81 C ATOM 993 O GLN B 28 -22.464 -5.657 -2.209 1.00 0.85 O ATOM 994 CB GLN B 28 -21.929 -2.995 -1.989 1.00 0.83 C ATOM 995 CG GLN B 28 -23.387 -2.563 -1.943 1.00 1.08 C ATOM 996 CD GLN B 28 -24.115 -2.796 -3.254 1.00 1.25 C ATOM 997 OE1 GLN B 28 -24.962 -2.001 -3.657 1.00 1.36 O ATOM 998 NE2 GLN B 28 -23.818 -3.901 -3.918 1.00 1.57 N ATOM 0 H GLN B 28 -19.564 -3.481 -1.435 1.00 0.75 H new ATOM 0 HA GLN B 28 -22.014 -3.579 0.074 1.00 0.81 H new ATOM 0 HB2 GLN B 28 -21.296 -2.108 -1.973 1.00 0.83 H new ATOM 0 HB3 GLN B 28 -21.740 -3.505 -2.934 1.00 0.83 H new ATOM 0 HG2 GLN B 28 -23.897 -3.108 -1.149 1.00 1.08 H new ATOM 0 HG3 GLN B 28 -23.439 -1.505 -1.688 1.00 1.08 H new ATOM 0 HE21 GLN B 28 -23.110 -4.539 -3.555 1.00 1.57 H new ATOM 0 HE22 GLN B 28 -24.297 -4.115 -4.793 1.00 1.57 H new ATOM 1007 N ALA B 29 -21.786 -6.207 -0.134 1.00 0.81 N ATOM 1008 CA ALA B 29 -22.152 -7.612 -0.233 1.00 0.83 C ATOM 1009 C ALA B 29 -22.059 -8.273 1.134 1.00 0.87 C ATOM 1010 O ALA B 29 -22.985 -8.960 1.569 1.00 0.90 O ATOM 1011 CB ALA B 29 -21.253 -8.333 -1.229 1.00 0.83 C ATOM 0 H ALA B 29 -21.377 -5.950 0.764 1.00 0.81 H new ATOM 0 HA ALA B 29 -23.180 -7.678 -0.589 1.00 0.83 H new ATOM 0 HB1 ALA B 29 -21.543 -9.382 -1.288 1.00 0.83 H new ATOM 0 HB2 ALA B 29 -21.355 -7.872 -2.211 1.00 0.83 H new ATOM 0 HB3 ALA B 29 -20.216 -8.261 -0.901 1.00 0.83 H new ATOM 1017 N TYR B 30 -20.946 -8.042 1.816 1.00 0.87 N ATOM 1018 CA TYR B 30 -20.727 -8.625 3.131 1.00 0.91 C ATOM 1019 C TYR B 30 -20.813 -7.576 4.240 1.00 0.91 C ATOM 1020 O TYR B 30 -21.321 -7.854 5.322 1.00 1.01 O ATOM 1021 CB TYR B 30 -19.350 -9.298 3.196 1.00 0.94 C ATOM 1022 CG TYR B 30 -18.963 -10.084 1.961 1.00 0.92 C ATOM 1023 CD1 TYR B 30 -19.424 -11.380 1.759 1.00 0.99 C ATOM 1024 CD2 TYR B 30 -18.116 -9.534 1.007 1.00 0.93 C ATOM 1025 CE1 TYR B 30 -19.053 -12.103 0.640 1.00 1.07 C ATOM 1026 CE2 TYR B 30 -17.745 -10.249 -0.113 1.00 1.01 C ATOM 1027 CZ TYR B 30 -18.213 -11.532 -0.293 1.00 1.07 C ATOM 1028 OH TYR B 30 -17.833 -12.247 -1.404 1.00 1.20 O ATOM 0 H TYR B 30 -20.182 -7.456 1.481 1.00 0.87 H new ATOM 0 HA TYR B 30 -21.514 -9.363 3.286 1.00 0.91 H new ATOM 0 HB2 TYR B 30 -18.595 -8.531 3.372 1.00 0.94 H new ATOM 0 HB3 TYR B 30 -19.330 -9.968 4.056 1.00 0.94 H new ATOM 0 HD1 TYR B 30 -20.082 -11.829 2.488 1.00 0.99 H new ATOM 0 HD2 TYR B 30 -17.742 -8.530 1.144 1.00 0.93 H new ATOM 0 HE1 TYR B 30 -19.419 -13.109 0.498 1.00 1.07 H new ATOM 0 HE2 TYR B 30 -17.089 -9.804 -0.847 1.00 1.01 H new ATOM 0 HH TYR B 30 -16.861 -12.191 -1.512 1.00 1.20 H new ATOM 1038 N TYR B 31 -20.328 -6.368 3.962 1.00 0.86 N ATOM 1039 CA TYR B 31 -20.312 -5.306 4.965 1.00 0.87 C ATOM 1040 C TYR B 31 -21.709 -4.783 5.303 1.00 0.94 C ATOM 1041 O TYR B 31 -22.084 -4.741 6.475 1.00 1.03 O ATOM 1042 CB TYR B 31 -19.421 -4.157 4.509 1.00 0.81 C ATOM 1043 CG TYR B 31 -18.349 -3.789 5.508 1.00 0.77 C ATOM 1044 CD1 TYR B 31 -18.679 -3.385 6.795 1.00 0.88 C ATOM 1045 CD2 TYR B 31 -17.006 -3.848 5.164 1.00 0.71 C ATOM 1046 CE1 TYR B 31 -17.699 -3.048 7.710 1.00 0.89 C ATOM 1047 CE2 TYR B 31 -16.022 -3.512 6.074 1.00 0.68 C ATOM 1048 CZ TYR B 31 -16.373 -3.114 7.345 1.00 0.75 C ATOM 1049 OH TYR B 31 -15.395 -2.780 8.253 1.00 0.77 O ATOM 0 H TYR B 31 -19.943 -6.101 3.056 1.00 0.86 H new ATOM 0 HA TYR B 31 -19.907 -5.746 5.877 1.00 0.87 H new ATOM 0 HB2 TYR B 31 -18.948 -4.428 3.565 1.00 0.81 H new ATOM 0 HB3 TYR B 31 -20.041 -3.282 4.316 1.00 0.81 H new ATOM 0 HD1 TYR B 31 -19.718 -3.333 7.086 1.00 0.88 H new ATOM 0 HD2 TYR B 31 -16.725 -4.161 4.169 1.00 0.71 H new ATOM 0 HE1 TYR B 31 -17.972 -2.734 8.707 1.00 0.89 H new ATOM 0 HE2 TYR B 31 -14.981 -3.561 5.790 1.00 0.68 H new ATOM 0 HH TYR B 31 -14.545 -2.647 7.784 1.00 0.77 H new ATOM 1059 N CYS B 32 -22.467 -4.348 4.297 1.00 0.94 N ATOM 1060 CA CYS B 32 -23.812 -3.842 4.540 1.00 1.02 C ATOM 1061 C CYS B 32 -24.772 -5.002 4.795 1.00 1.07 C ATOM 1062 O CYS B 32 -25.630 -5.306 3.963 1.00 1.10 O ATOM 1063 CB CYS B 32 -24.290 -3.011 3.355 1.00 1.01 C ATOM 1064 SG CYS B 32 -22.949 -2.331 2.327 1.00 0.98 S ATOM 0 H CYS B 32 -22.176 -4.336 3.320 1.00 0.94 H new ATOM 0 HA CYS B 32 -23.790 -3.204 5.423 1.00 1.02 H new ATOM 0 HB2 CYS B 32 -24.934 -3.629 2.729 1.00 1.01 H new ATOM 0 HB3 CYS B 32 -24.901 -2.188 3.726 1.00 1.01 H new ATOM 0 HG CYS B 32 -22.004 -1.873 3.094 1.00 0.98 H new ATOM 1069 N SER B 33 -24.590 -5.646 5.940 1.00 1.09 N ATOM 1070 CA SER B 33 -25.396 -6.789 6.343 1.00 1.16 C ATOM 1071 C SER B 33 -25.167 -7.960 5.385 1.00 1.09 C ATOM 1072 O SER B 33 -24.273 -8.776 5.600 1.00 1.07 O ATOM 1073 CB SER B 33 -26.882 -6.414 6.423 1.00 1.27 C ATOM 1074 OG SER B 33 -27.089 -5.345 7.334 1.00 1.43 O ATOM 0 H SER B 33 -23.874 -5.388 6.619 1.00 1.09 H new ATOM 0 HA SER B 33 -25.085 -7.099 7.341 1.00 1.16 H new ATOM 0 HB2 SER B 33 -27.242 -6.129 5.435 1.00 1.27 H new ATOM 0 HB3 SER B 33 -27.463 -7.281 6.736 1.00 1.27 H new ATOM 0 HG SER B 33 -28.043 -5.123 7.366 1.00 1.43 H new ATOM 1080 N HIS B 34 -25.952 -8.016 4.314 1.00 1.10 N ATOM 1081 CA HIS B 34 -25.834 -9.077 3.321 1.00 1.07 C ATOM 1082 C HIS B 34 -26.524 -8.663 2.030 1.00 1.06 C ATOM 1083 O HIS B 34 -27.679 -9.017 1.789 1.00 1.14 O ATOM 1084 CB HIS B 34 -26.433 -10.393 3.838 1.00 1.14 C ATOM 1085 CG HIS B 34 -25.427 -11.302 4.480 1.00 1.09 C ATOM 1086 ND1 HIS B 34 -25.542 -11.748 5.775 1.00 1.18 N ATOM 1087 CD2 HIS B 34 -24.281 -11.839 3.999 1.00 1.04 C ATOM 1088 CE1 HIS B 34 -24.511 -12.517 6.066 1.00 1.14 C ATOM 1089 NE2 HIS B 34 -23.726 -12.590 5.005 1.00 1.06 N ATOM 0 H HIS B 34 -26.682 -7.333 4.111 1.00 1.10 H new ATOM 0 HA HIS B 34 -24.774 -9.241 3.127 1.00 1.07 H new ATOM 0 HB2 HIS B 34 -27.217 -10.166 4.560 1.00 1.14 H new ATOM 0 HB3 HIS B 34 -26.906 -10.918 3.008 1.00 1.14 H new ATOM 0 HD2 HIS B 34 -23.878 -11.702 3.007 1.00 1.04 H new ATOM 0 HE1 HIS B 34 -24.337 -13.006 7.013 1.00 1.14 H new ATOM 0 HE2 HIS B 34 -22.854 -13.116 4.944 1.00 1.06 H new ATOM 1098 N ARG B 35 -25.814 -7.904 1.205 1.00 0.99 N ATOM 1099 CA ARG B 35 -26.358 -7.430 -0.066 1.00 0.99 C ATOM 1100 C ARG B 35 -26.224 -8.520 -1.127 1.00 1.01 C ATOM 1101 O ARG B 35 -25.664 -8.302 -2.203 1.00 1.03 O ATOM 1102 CB ARG B 35 -25.639 -6.150 -0.525 1.00 0.94 C ATOM 1103 CG ARG B 35 -25.448 -5.115 0.577 1.00 0.94 C ATOM 1104 CD ARG B 35 -26.711 -4.301 0.829 1.00 1.04 C ATOM 1105 NE ARG B 35 -26.957 -3.309 -0.224 1.00 1.05 N ATOM 1106 CZ ARG B 35 -26.471 -2.061 -0.216 1.00 1.06 C ATOM 1107 NH1 ARG B 35 -25.628 -1.664 0.735 1.00 1.04 N ATOM 1108 NH2 ARG B 35 -26.807 -1.218 -1.186 1.00 1.11 N ATOM 0 H ARG B 35 -24.858 -7.602 1.392 1.00 0.99 H new ATOM 0 HA ARG B 35 -27.413 -7.196 0.075 1.00 0.99 H new ATOM 0 HB2 ARG B 35 -24.663 -6.419 -0.929 1.00 0.94 H new ATOM 0 HB3 ARG B 35 -26.207 -5.699 -1.338 1.00 0.94 H new ATOM 0 HG2 ARG B 35 -25.152 -5.618 1.498 1.00 0.94 H new ATOM 0 HG3 ARG B 35 -24.634 -4.444 0.305 1.00 0.94 H new ATOM 0 HD2 ARG B 35 -27.566 -4.974 0.897 1.00 1.04 H new ATOM 0 HD3 ARG B 35 -26.627 -3.793 1.790 1.00 1.04 H new ATOM 0 HE ARG B 35 -27.537 -3.589 -1.015 1.00 1.05 H new ATOM 0 HH11 ARG B 35 -25.345 -2.313 1.469 1.00 1.04 H new ATOM 0 HH12 ARG B 35 -25.265 -0.711 0.729 1.00 1.04 H new ATOM 0 HH21 ARG B 35 -27.432 -1.522 -1.932 1.00 1.11 H new ATOM 0 HH22 ARG B 35 -26.440 -0.266 -1.185 1.00 1.11 H new ATOM 1122 N ILE B 36 -26.744 -9.697 -0.813 1.00 1.07 N ATOM 1123 CA ILE B 36 -26.683 -10.832 -1.717 1.00 1.12 C ATOM 1124 C ILE B 36 -28.067 -11.159 -2.256 1.00 1.32 C ATOM 1125 O ILE B 36 -28.203 -12.157 -2.988 1.00 1.45 O ATOM 1126 CB ILE B 36 -26.102 -12.081 -1.018 1.00 1.06 C ATOM 1127 CG1 ILE B 36 -26.874 -12.375 0.272 1.00 1.12 C ATOM 1128 CG2 ILE B 36 -24.620 -11.885 -0.730 1.00 1.04 C ATOM 1129 CD1 ILE B 36 -26.481 -13.677 0.937 1.00 1.18 C ATOM 1130 OXT ILE B 36 -29.021 -10.414 -1.933 1.00 1.45 O ATOM 0 H ILE B 36 -27.217 -9.890 0.070 1.00 1.07 H new ATOM 0 HA ILE B 36 -26.025 -10.555 -2.541 1.00 1.12 H new ATOM 0 HB ILE B 36 -26.209 -12.938 -1.683 1.00 1.06 H new ATOM 0 HG12 ILE B 36 -26.714 -11.557 0.974 1.00 1.12 H new ATOM 0 HG13 ILE B 36 -27.941 -12.400 0.048 1.00 1.12 H new ATOM 0 HG21 ILE B 36 -24.225 -12.773 -0.237 1.00 1.04 H new ATOM 0 HG22 ILE B 36 -24.086 -11.721 -1.666 1.00 1.04 H new ATOM 0 HG23 ILE B 36 -24.487 -11.020 -0.080 1.00 1.04 H new ATOM 0 HD11 ILE B 36 -27.070 -13.815 1.843 1.00 1.18 H new ATOM 0 HD12 ILE B 36 -26.667 -14.505 0.253 1.00 1.18 H new ATOM 0 HD13 ILE B 36 -25.422 -13.649 1.194 1.00 1.18 H new ATOM 1272 N ASP C 91 22.276 -2.769 -5.049 1.00 1.08 N ATOM 1273 CA ASP C 91 23.179 -1.612 -5.085 1.00 1.09 C ATOM 1274 C ASP C 91 24.437 -1.853 -4.255 1.00 1.14 C ATOM 1275 O ASP C 91 25.557 -1.637 -4.723 1.00 1.53 O ATOM 1276 CB ASP C 91 22.455 -0.364 -4.574 1.00 1.03 C ATOM 1277 CG ASP C 91 23.385 0.819 -4.380 1.00 1.19 C ATOM 1278 OD1 ASP C 91 23.594 1.580 -5.347 1.00 1.54 O ATOM 1279 OD2 ASP C 91 23.904 0.996 -3.256 1.00 1.34 O ATOM 0 HA ASP C 91 23.482 -1.462 -6.121 1.00 1.09 H new ATOM 0 HB2 ASP C 91 21.670 -0.091 -5.279 1.00 1.03 H new ATOM 0 HB3 ASP C 91 21.967 -0.595 -3.627 1.00 1.03 H new ATOM 1284 N GLY C 92 24.245 -2.294 -3.021 1.00 0.94 N ATOM 1285 CA GLY C 92 25.368 -2.560 -2.150 1.00 1.00 C ATOM 1286 C GLY C 92 25.145 -2.043 -0.743 1.00 0.95 C ATOM 1287 O GLY C 92 25.284 -2.790 0.229 1.00 1.04 O ATOM 0 H GLY C 92 23.330 -2.472 -2.608 1.00 0.94 H new ATOM 0 HA2 GLY C 92 25.550 -3.634 -2.115 1.00 1.00 H new ATOM 0 HA3 GLY C 92 26.264 -2.098 -2.566 1.00 1.00 H new ATOM 1291 N LEU C 93 24.780 -0.774 -0.632 1.00 0.88 N ATOM 1292 CA LEU C 93 24.544 -0.156 0.668 1.00 0.88 C ATOM 1293 C LEU C 93 23.149 0.449 0.734 1.00 0.83 C ATOM 1294 O LEU C 93 22.515 0.684 -0.295 1.00 0.84 O ATOM 1295 CB LEU C 93 25.592 0.923 0.950 1.00 0.98 C ATOM 1296 CG LEU C 93 26.960 0.411 1.407 1.00 1.17 C ATOM 1297 CD1 LEU C 93 27.956 1.558 1.479 1.00 1.58 C ATOM 1298 CD2 LEU C 93 26.849 -0.284 2.757 1.00 1.17 C ATOM 0 H LEU C 93 24.640 -0.150 -1.427 1.00 0.88 H new ATOM 0 HA LEU C 93 24.624 -0.933 1.428 1.00 0.88 H new ATOM 0 HB2 LEU C 93 25.729 1.516 0.046 1.00 0.98 H new ATOM 0 HB3 LEU C 93 25.201 1.594 1.715 1.00 0.98 H new ATOM 0 HG LEU C 93 27.318 -0.315 0.677 1.00 1.17 H new ATOM 0 HD11 LEU C 93 28.924 1.179 1.805 1.00 1.58 H new ATOM 0 HD12 LEU C 93 28.058 2.014 0.494 1.00 1.58 H new ATOM 0 HD13 LEU C 93 27.600 2.305 2.189 1.00 1.58 H new ATOM 0 HD21 LEU C 93 27.832 -0.641 3.064 1.00 1.17 H new ATOM 0 HD22 LEU C 93 26.470 0.420 3.498 1.00 1.17 H new ATOM 0 HD23 LEU C 93 26.165 -1.129 2.676 1.00 1.17 H new ATOM 1310 N CYS C 94 22.684 0.697 1.951 1.00 0.81 N ATOM 1311 CA CYS C 94 21.367 1.270 2.182 1.00 0.77 C ATOM 1312 C CYS C 94 21.382 2.776 1.966 1.00 0.84 C ATOM 1313 O CYS C 94 22.365 3.350 1.493 1.00 1.04 O ATOM 1314 CB CYS C 94 20.927 0.973 3.617 1.00 0.75 C ATOM 1315 SG CYS C 94 19.137 1.135 3.943 1.00 0.70 S ATOM 0 H CYS C 94 23.209 0.506 2.804 1.00 0.81 H new ATOM 0 HA CYS C 94 20.669 0.823 1.474 1.00 0.77 H new ATOM 0 HB2 CYS C 94 21.234 -0.042 3.869 1.00 0.75 H new ATOM 0 HB3 CYS C 94 21.463 1.644 4.289 1.00 0.75 H new ATOM 0 HG CYS C 94 18.651 -0.022 4.281 1.00 0.70 H new ATOM 1320 N ALA C 95 20.281 3.396 2.332 1.00 0.79 N ATOM 1321 CA ALA C 95 20.121 4.832 2.220 1.00 0.88 C ATOM 1322 C ALA C 95 19.678 5.403 3.558 1.00 0.82 C ATOM 1323 O ALA C 95 19.800 6.603 3.810 1.00 0.92 O ATOM 1324 CB ALA C 95 19.119 5.174 1.131 1.00 1.00 C ATOM 0 H ALA C 95 19.467 2.917 2.718 1.00 0.79 H new ATOM 0 HA ALA C 95 21.078 5.276 1.947 1.00 0.88 H new ATOM 0 HB1 ALA C 95 19.012 6.257 1.062 1.00 1.00 H new ATOM 0 HB2 ALA C 95 19.471 4.782 0.177 1.00 1.00 H new ATOM 0 HB3 ALA C 95 18.154 4.729 1.372 1.00 1.00 H new ATOM 1330 N SER C 96 19.170 4.525 4.416 1.00 0.72 N ATOM 1331 CA SER C 96 18.718 4.927 5.734 1.00 0.70 C ATOM 1332 C SER C 96 19.626 4.340 6.812 1.00 0.69 C ATOM 1333 O SER C 96 19.866 4.975 7.842 1.00 0.74 O ATOM 1334 CB SER C 96 17.267 4.495 5.959 1.00 0.70 C ATOM 1335 OG SER C 96 16.413 5.053 4.973 1.00 0.77 O ATOM 0 H SER C 96 19.063 3.530 4.218 1.00 0.72 H new ATOM 0 HA SER C 96 18.766 6.014 5.798 1.00 0.70 H new ATOM 0 HB2 SER C 96 17.199 3.407 5.931 1.00 0.70 H new ATOM 0 HB3 SER C 96 16.939 4.810 6.950 1.00 0.70 H new ATOM 0 HG SER C 96 16.329 4.429 4.222 1.00 0.77 H new ATOM 1341 N CYS C 97 20.133 3.130 6.578 1.00 0.69 N ATOM 1342 CA CYS C 97 21.017 2.488 7.537 1.00 0.69 C ATOM 1343 C CYS C 97 22.409 2.303 6.921 1.00 0.73 C ATOM 1344 O CYS C 97 22.720 2.904 5.887 1.00 0.90 O ATOM 1345 CB CYS C 97 20.415 1.155 8.029 1.00 0.67 C ATOM 1346 SG CYS C 97 20.663 -0.285 6.931 1.00 0.69 S ATOM 0 H CYS C 97 19.946 2.582 5.738 1.00 0.69 H new ATOM 0 HA CYS C 97 21.124 3.128 8.413 1.00 0.69 H new ATOM 0 HB2 CYS C 97 20.844 0.923 9.004 1.00 0.67 H new ATOM 0 HB3 CYS C 97 19.344 1.295 8.177 1.00 0.67 H new ATOM 0 HG CYS C 97 20.035 -0.089 5.810 1.00 0.69 H new ATOM 1351 N ASP C 98 23.245 1.492 7.557 1.00 0.79 N ATOM 1352 CA ASP C 98 24.601 1.249 7.069 1.00 0.82 C ATOM 1353 C ASP C 98 24.836 -0.238 6.866 1.00 0.83 C ATOM 1354 O ASP C 98 25.980 -0.696 6.796 1.00 0.97 O ATOM 1355 CB ASP C 98 25.642 1.793 8.054 1.00 0.86 C ATOM 1356 CG ASP C 98 25.862 3.289 7.928 1.00 0.96 C ATOM 1357 OD1 ASP C 98 26.396 3.739 6.891 1.00 1.32 O ATOM 1358 OD2 ASP C 98 25.526 4.025 8.887 1.00 1.41 O ATOM 0 H ASP C 98 23.010 0.990 8.413 1.00 0.79 H new ATOM 0 HA ASP C 98 24.707 1.767 6.116 1.00 0.82 H new ATOM 0 HB2 ASP C 98 25.324 1.564 9.071 1.00 0.86 H new ATOM 0 HB3 ASP C 98 26.589 1.278 7.892 1.00 0.86 H new ATOM 1363 N LYS C 99 23.759 -0.995 6.781 1.00 0.83 N ATOM 1364 CA LYS C 99 23.868 -2.429 6.592 1.00 0.85 C ATOM 1365 C LYS C 99 23.926 -2.771 5.111 1.00 0.86 C ATOM 1366 O LYS C 99 23.133 -2.268 4.315 1.00 0.92 O ATOM 1367 CB LYS C 99 22.691 -3.148 7.254 1.00 0.82 C ATOM 1368 CG LYS C 99 22.605 -2.920 8.757 1.00 0.90 C ATOM 1369 CD LYS C 99 23.943 -3.156 9.433 1.00 1.00 C ATOM 1370 CE LYS C 99 23.826 -3.103 10.946 1.00 1.21 C ATOM 1371 NZ LYS C 99 25.161 -3.060 11.597 1.00 1.44 N ATOM 0 H LYS C 99 22.803 -0.644 6.839 1.00 0.83 H new ATOM 0 HA LYS C 99 24.792 -2.766 7.062 1.00 0.85 H new ATOM 0 HB2 LYS C 99 21.764 -2.812 6.790 1.00 0.82 H new ATOM 0 HB3 LYS C 99 22.775 -4.218 7.061 1.00 0.82 H new ATOM 0 HG2 LYS C 99 22.272 -1.901 8.953 1.00 0.90 H new ATOM 0 HG3 LYS C 99 21.857 -3.588 9.185 1.00 0.90 H new ATOM 0 HD2 LYS C 99 24.336 -4.127 9.132 1.00 1.00 H new ATOM 0 HD3 LYS C 99 24.658 -2.405 9.097 1.00 1.00 H new ATOM 0 HE2 LYS C 99 23.251 -2.224 11.236 1.00 1.21 H new ATOM 0 HE3 LYS C 99 23.276 -3.975 11.300 1.00 1.21 H new ATOM 0 HZ1 LYS C 99 25.043 -3.024 12.630 1.00 1.44 H new ATOM 0 HZ2 LYS C 99 25.700 -3.911 11.339 1.00 1.44 H new ATOM 0 HZ3 LYS C 99 25.676 -2.214 11.278 1.00 1.44 H new ATOM 1385 N ARG C 100 24.876 -3.626 4.751 1.00 0.84 N ATOM 1386 CA ARG C 100 25.045 -4.050 3.370 1.00 0.88 C ATOM 1387 C ARG C 100 23.805 -4.793 2.900 1.00 0.85 C ATOM 1388 O ARG C 100 23.177 -5.523 3.674 1.00 0.85 O ATOM 1389 CB ARG C 100 26.274 -4.947 3.231 1.00 0.94 C ATOM 1390 CG ARG C 100 27.568 -4.281 3.678 1.00 1.08 C ATOM 1391 CD ARG C 100 28.757 -5.225 3.557 1.00 1.14 C ATOM 1392 NE ARG C 100 28.574 -6.451 4.338 1.00 1.20 N ATOM 1393 CZ ARG C 100 29.038 -6.631 5.575 1.00 1.28 C ATOM 1394 NH1 ARG C 100 29.674 -5.650 6.201 1.00 1.42 N ATOM 1395 NH2 ARG C 100 28.848 -7.791 6.189 1.00 1.48 N ATOM 0 H ARG C 100 25.543 -4.040 5.402 1.00 0.84 H new ATOM 0 HA ARG C 100 25.189 -3.165 2.750 1.00 0.88 H new ATOM 0 HB2 ARG C 100 26.120 -5.853 3.817 1.00 0.94 H new ATOM 0 HB3 ARG C 100 26.374 -5.254 2.190 1.00 0.94 H new ATOM 0 HG2 ARG C 100 27.747 -3.391 3.075 1.00 1.08 H new ATOM 0 HG3 ARG C 100 27.469 -3.951 4.712 1.00 1.08 H new ATOM 0 HD2 ARG C 100 28.908 -5.483 2.509 1.00 1.14 H new ATOM 0 HD3 ARG C 100 29.660 -4.714 3.893 1.00 1.14 H new ATOM 0 HE ARG C 100 28.057 -7.218 3.907 1.00 1.20 H new ATOM 0 HH11 ARG C 100 29.810 -4.752 5.736 1.00 1.42 H new ATOM 0 HH12 ARG C 100 30.027 -5.793 7.147 1.00 1.42 H new ATOM 0 HH21 ARG C 100 28.348 -8.543 5.715 1.00 1.48 H new ATOM 0 HH22 ARG C 100 29.202 -7.931 7.135 1.00 1.48 H new ATOM 1409 N ILE C 101 23.445 -4.602 1.643 1.00 0.88 N ATOM 1410 CA ILE C 101 22.271 -5.252 1.092 1.00 0.86 C ATOM 1411 C ILE C 101 22.588 -6.685 0.676 1.00 0.90 C ATOM 1412 O ILE C 101 23.615 -6.958 0.051 1.00 0.95 O ATOM 1413 CB ILE C 101 21.691 -4.479 -0.110 1.00 0.87 C ATOM 1414 CG1 ILE C 101 21.719 -2.970 0.155 1.00 0.83 C ATOM 1415 CG2 ILE C 101 20.267 -4.942 -0.391 1.00 0.90 C ATOM 1416 CD1 ILE C 101 21.181 -2.143 -0.992 1.00 0.84 C ATOM 0 H ILE C 101 23.947 -4.004 0.987 1.00 0.88 H new ATOM 0 HA ILE C 101 21.519 -5.264 1.881 1.00 0.86 H new ATOM 0 HB ILE C 101 22.307 -4.684 -0.986 1.00 0.87 H new ATOM 0 HG12 ILE C 101 21.136 -2.756 1.051 1.00 0.83 H new ATOM 0 HG13 ILE C 101 22.745 -2.665 0.362 1.00 0.83 H new ATOM 0 HG21 ILE C 101 19.866 -4.390 -1.241 1.00 0.90 H new ATOM 0 HG22 ILE C 101 20.269 -6.008 -0.618 1.00 0.90 H new ATOM 0 HG23 ILE C 101 19.645 -4.759 0.486 1.00 0.90 H new ATOM 0 HD11 ILE C 101 21.232 -1.085 -0.733 1.00 0.84 H new ATOM 0 HD12 ILE C 101 21.778 -2.327 -1.885 1.00 0.84 H new ATOM 0 HD13 ILE C 101 20.145 -2.420 -1.185 1.00 0.84 H new ATOM 1428 N ARG C 102 21.710 -7.593 1.060 1.00 0.89 N ATOM 1429 CA ARG C 102 21.855 -9.004 0.744 1.00 0.92 C ATOM 1430 C ARG C 102 20.567 -9.502 0.109 1.00 0.91 C ATOM 1431 O ARG C 102 19.761 -8.700 -0.356 1.00 0.90 O ATOM 1432 CB ARG C 102 22.146 -9.799 2.018 1.00 0.95 C ATOM 1433 CG ARG C 102 23.510 -9.523 2.624 1.00 1.01 C ATOM 1434 CD ARG C 102 24.620 -10.149 1.801 1.00 1.09 C ATOM 1435 NE ARG C 102 25.145 -9.234 0.789 1.00 1.15 N ATOM 1436 CZ ARG C 102 26.347 -9.359 0.234 1.00 1.37 C ATOM 1437 NH1 ARG C 102 27.129 -10.384 0.550 1.00 1.55 N ATOM 1438 NH2 ARG C 102 26.759 -8.471 -0.658 1.00 1.48 N ATOM 0 H ARG C 102 20.874 -7.373 1.601 1.00 0.89 H new ATOM 0 HA ARG C 102 22.685 -9.139 0.050 1.00 0.92 H new ATOM 0 HB2 ARG C 102 21.379 -9.572 2.758 1.00 0.95 H new ATOM 0 HB3 ARG C 102 22.068 -10.863 1.795 1.00 0.95 H new ATOM 0 HG2 ARG C 102 23.668 -8.447 2.692 1.00 1.01 H new ATOM 0 HG3 ARG C 102 23.544 -9.915 3.641 1.00 1.01 H new ATOM 0 HD2 ARG C 102 25.429 -10.458 2.462 1.00 1.09 H new ATOM 0 HD3 ARG C 102 24.245 -11.049 1.314 1.00 1.09 H new ATOM 0 HE ARG C 102 24.556 -8.456 0.492 1.00 1.15 H new ATOM 0 HH11 ARG C 102 26.809 -11.081 1.222 1.00 1.55 H new ATOM 0 HH12 ARG C 102 28.050 -10.474 0.121 1.00 1.55 H new ATOM 0 HH21 ARG C 102 26.155 -7.692 -0.919 1.00 1.48 H new ATOM 0 HH22 ARG C 102 27.681 -8.566 -1.084 1.00 1.48 H new ATOM 1452 N ALA C 103 20.364 -10.816 0.102 1.00 0.94 N ATOM 1453 CA ALA C 103 19.143 -11.389 -0.450 1.00 0.96 C ATOM 1454 C ALA C 103 17.966 -11.038 0.456 1.00 0.94 C ATOM 1455 O ALA C 103 16.799 -11.178 0.086 1.00 1.30 O ATOM 1456 CB ALA C 103 19.280 -12.897 -0.592 1.00 1.06 C ATOM 0 H ALA C 103 21.025 -11.500 0.470 1.00 0.94 H new ATOM 0 HA ALA C 103 18.966 -10.973 -1.442 1.00 0.96 H new ATOM 0 HB1 ALA C 103 18.359 -13.309 -1.006 1.00 1.06 H new ATOM 0 HB2 ALA C 103 20.111 -13.126 -1.259 1.00 1.06 H new ATOM 0 HB3 ALA C 103 19.468 -13.339 0.387 1.00 1.06 H new ATOM 1462 N TYR C 104 18.303 -10.575 1.652 1.00 0.87 N ATOM 1463 CA TYR C 104 17.329 -10.174 2.651 1.00 0.81 C ATOM 1464 C TYR C 104 16.965 -8.700 2.464 1.00 0.74 C ATOM 1465 O TYR C 104 17.083 -7.888 3.386 1.00 0.82 O ATOM 1466 CB TYR C 104 17.911 -10.419 4.050 1.00 0.86 C ATOM 1467 CG TYR C 104 16.929 -10.245 5.190 1.00 0.89 C ATOM 1468 CD1 TYR C 104 15.671 -10.833 5.155 1.00 0.98 C ATOM 1469 CD2 TYR C 104 17.270 -9.492 6.307 1.00 0.90 C ATOM 1470 CE1 TYR C 104 14.781 -10.675 6.202 1.00 1.08 C ATOM 1471 CE2 TYR C 104 16.388 -9.333 7.356 1.00 1.00 C ATOM 1472 CZ TYR C 104 15.147 -9.922 7.301 1.00 1.08 C ATOM 1473 OH TYR C 104 14.270 -9.761 8.349 1.00 1.23 O ATOM 0 H TYR C 104 19.271 -10.467 1.956 1.00 0.87 H new ATOM 0 HA TYR C 104 16.420 -10.765 2.538 1.00 0.81 H new ATOM 0 HB2 TYR C 104 18.313 -11.431 4.088 1.00 0.86 H new ATOM 0 HB3 TYR C 104 18.748 -9.738 4.204 1.00 0.86 H new ATOM 0 HD1 TYR C 104 15.383 -11.423 4.297 1.00 0.98 H new ATOM 0 HD2 TYR C 104 18.242 -9.023 6.355 1.00 0.90 H new ATOM 0 HE1 TYR C 104 13.806 -11.137 6.161 1.00 1.08 H new ATOM 0 HE2 TYR C 104 16.672 -8.747 8.218 1.00 1.00 H new ATOM 0 HH TYR C 104 14.685 -9.205 9.041 1.00 1.23 H new ATOM 1483 N GLU C 105 16.567 -8.350 1.252 1.00 0.87 N ATOM 1484 CA GLU C 105 16.167 -6.986 0.951 1.00 0.84 C ATOM 1485 C GLU C 105 14.645 -6.902 0.885 1.00 0.74 C ATOM 1486 O GLU C 105 14.017 -6.296 1.755 1.00 0.74 O ATOM 1487 CB GLU C 105 16.816 -6.491 -0.352 1.00 0.96 C ATOM 1488 CG GLU C 105 16.795 -7.501 -1.489 1.00 1.04 C ATOM 1489 CD GLU C 105 16.092 -6.965 -2.721 1.00 1.16 C ATOM 1490 OE1 GLU C 105 15.003 -6.367 -2.573 1.00 1.55 O ATOM 1491 OE2 GLU C 105 16.626 -7.141 -3.834 1.00 1.43 O ATOM 0 H GLU C 105 16.512 -8.992 0.461 1.00 0.87 H new ATOM 0 HA GLU C 105 16.517 -6.331 1.748 1.00 0.84 H new ATOM 0 HB2 GLU C 105 16.304 -5.586 -0.677 1.00 0.96 H new ATOM 0 HB3 GLU C 105 17.850 -6.216 -0.146 1.00 0.96 H new ATOM 0 HG2 GLU C 105 17.818 -7.775 -1.747 1.00 1.04 H new ATOM 0 HG3 GLU C 105 16.296 -8.411 -1.155 1.00 1.04 H new ATOM 1498 N MET C 106 14.069 -7.532 -0.140 1.00 0.74 N ATOM 1499 CA MET C 106 12.623 -7.572 -0.340 1.00 0.75 C ATOM 1500 C MET C 106 12.015 -6.176 -0.287 1.00 0.66 C ATOM 1501 O MET C 106 11.036 -5.932 0.423 1.00 0.73 O ATOM 1502 CB MET C 106 11.964 -8.485 0.702 1.00 0.84 C ATOM 1503 CG MET C 106 12.176 -9.964 0.427 1.00 0.94 C ATOM 1504 SD MET C 106 11.519 -11.017 1.735 1.00 1.07 S ATOM 1505 CE MET C 106 11.616 -12.626 0.957 1.00 1.19 C ATOM 0 H MET C 106 14.596 -8.030 -0.857 1.00 0.74 H new ATOM 0 HA MET C 106 12.434 -7.979 -1.333 1.00 0.75 H new ATOM 0 HB2 MET C 106 12.362 -8.245 1.688 1.00 0.84 H new ATOM 0 HB3 MET C 106 10.894 -8.278 0.731 1.00 0.84 H new ATOM 0 HG2 MET C 106 11.700 -10.225 -0.518 1.00 0.94 H new ATOM 0 HG3 MET C 106 13.242 -10.158 0.311 1.00 0.94 H new ATOM 0 HE1 MET C 106 11.244 -13.386 1.644 1.00 1.19 H new ATOM 0 HE2 MET C 106 11.011 -12.629 0.050 1.00 1.19 H new ATOM 0 HE3 MET C 106 12.653 -12.845 0.702 1.00 1.19 H new ATOM 1515 N THR C 107 12.594 -5.264 -1.047 1.00 0.59 N ATOM 1516 CA THR C 107 12.114 -3.899 -1.084 1.00 0.52 C ATOM 1517 C THR C 107 11.446 -3.608 -2.425 1.00 0.54 C ATOM 1518 O THR C 107 11.584 -4.379 -3.377 1.00 0.68 O ATOM 1519 CB THR C 107 13.263 -2.898 -0.826 1.00 0.55 C ATOM 1520 OG1 THR C 107 12.730 -1.641 -0.388 1.00 0.56 O ATOM 1521 CG2 THR C 107 14.112 -2.689 -2.073 1.00 0.70 C ATOM 0 H THR C 107 13.398 -5.447 -1.647 1.00 0.59 H new ATOM 0 HA THR C 107 11.377 -3.778 -0.290 1.00 0.52 H new ATOM 0 HB THR C 107 13.901 -3.317 -0.048 1.00 0.55 H new ATOM 0 HG1 THR C 107 13.465 -1.013 -0.225 1.00 0.56 H new ATOM 0 HG21 THR C 107 14.910 -1.979 -1.855 1.00 0.70 H new ATOM 0 HG22 THR C 107 14.546 -3.640 -2.381 1.00 0.70 H new ATOM 0 HG23 THR C 107 13.488 -2.298 -2.877 1.00 0.70 H new ATOM 1529 N MET C 108 10.714 -2.505 -2.490 1.00 0.52 N ATOM 1530 CA MET C 108 10.030 -2.114 -3.714 1.00 0.55 C ATOM 1531 C MET C 108 10.982 -1.342 -4.613 1.00 0.58 C ATOM 1532 O MET C 108 11.869 -0.644 -4.123 1.00 0.63 O ATOM 1533 CB MET C 108 8.790 -1.270 -3.399 1.00 0.55 C ATOM 1534 CG MET C 108 7.515 -2.092 -3.245 1.00 0.64 C ATOM 1535 SD MET C 108 7.530 -3.153 -1.785 1.00 1.11 S ATOM 1536 CE MET C 108 7.515 -1.928 -0.475 1.00 1.04 C ATOM 0 H MET C 108 10.578 -1.864 -1.708 1.00 0.52 H new ATOM 0 HA MET C 108 9.702 -3.015 -4.233 1.00 0.55 H new ATOM 0 HB2 MET C 108 8.965 -0.711 -2.480 1.00 0.55 H new ATOM 0 HB3 MET C 108 8.647 -0.539 -4.194 1.00 0.55 H new ATOM 0 HG2 MET C 108 6.660 -1.418 -3.189 1.00 0.64 H new ATOM 0 HG3 MET C 108 7.377 -2.708 -4.133 1.00 0.64 H new ATOM 0 HE1 MET C 108 7.170 -2.389 0.451 1.00 1.04 H new ATOM 0 HE2 MET C 108 8.522 -1.536 -0.332 1.00 1.04 H new ATOM 0 HE3 MET C 108 6.844 -1.113 -0.746 1.00 1.04 H new ATOM 1546 N ARG C 109 10.804 -1.484 -5.919 1.00 0.60 N ATOM 1547 CA ARG C 109 11.650 -0.808 -6.897 1.00 0.66 C ATOM 1548 C ARG C 109 11.621 0.708 -6.703 1.00 0.63 C ATOM 1549 O ARG C 109 10.566 1.338 -6.803 1.00 0.72 O ATOM 1550 CB ARG C 109 11.198 -1.160 -8.315 1.00 0.76 C ATOM 1551 CG ARG C 109 12.328 -1.180 -9.331 1.00 0.88 C ATOM 1552 CD ARG C 109 13.203 -2.415 -9.173 1.00 1.00 C ATOM 1553 NE ARG C 109 14.050 -2.632 -10.348 1.00 1.13 N ATOM 1554 CZ ARG C 109 13.731 -3.441 -11.364 1.00 1.29 C ATOM 1555 NH1 ARG C 109 12.596 -4.138 -11.334 1.00 1.48 N ATOM 1556 NH2 ARG C 109 14.548 -3.557 -12.404 1.00 1.48 N ATOM 0 H ARG C 109 10.075 -2.067 -6.330 1.00 0.60 H new ATOM 0 HA ARG C 109 12.674 -1.150 -6.748 1.00 0.66 H new ATOM 0 HB2 ARG C 109 10.717 -2.138 -8.301 1.00 0.76 H new ATOM 0 HB3 ARG C 109 10.446 -0.439 -8.636 1.00 0.76 H new ATOM 0 HG2 ARG C 109 11.913 -1.154 -10.338 1.00 0.88 H new ATOM 0 HG3 ARG C 109 12.938 -0.284 -9.215 1.00 0.88 H new ATOM 0 HD2 ARG C 109 13.830 -2.306 -8.288 1.00 1.00 H new ATOM 0 HD3 ARG C 109 12.573 -3.290 -9.012 1.00 1.00 H new ATOM 0 HE ARG C 109 14.939 -2.135 -10.394 1.00 1.13 H new ATOM 0 HH11 ARG C 109 11.968 -4.055 -10.535 1.00 1.48 H new ATOM 0 HH12 ARG C 109 12.355 -4.754 -12.110 1.00 1.48 H new ATOM 0 HH21 ARG C 109 15.420 -3.029 -12.429 1.00 1.48 H new ATOM 0 HH22 ARG C 109 14.304 -4.174 -13.178 1.00 1.48 H new ATOM 1570 N VAL C 110 12.782 1.279 -6.410 1.00 0.64 N ATOM 1571 CA VAL C 110 12.906 2.717 -6.208 1.00 0.62 C ATOM 1572 C VAL C 110 13.655 3.341 -7.383 1.00 0.70 C ATOM 1573 O VAL C 110 13.818 2.699 -8.423 1.00 0.79 O ATOM 1574 CB VAL C 110 13.652 3.057 -4.893 1.00 0.66 C ATOM 1575 CG1 VAL C 110 12.940 4.180 -4.148 1.00 1.02 C ATOM 1576 CG2 VAL C 110 13.795 1.829 -4.003 1.00 0.87 C ATOM 0 H VAL C 110 13.657 0.765 -6.306 1.00 0.64 H new ATOM 0 HA VAL C 110 11.897 3.125 -6.140 1.00 0.62 H new ATOM 0 HB VAL C 110 14.654 3.396 -5.156 1.00 0.66 H new ATOM 0 HG11 VAL C 110 13.479 4.405 -3.227 1.00 1.02 H new ATOM 0 HG12 VAL C 110 12.908 5.070 -4.776 1.00 1.02 H new ATOM 0 HG13 VAL C 110 11.923 3.869 -3.907 1.00 1.02 H new ATOM 0 HG21 VAL C 110 14.323 2.102 -3.089 1.00 0.87 H new ATOM 0 HG22 VAL C 110 12.806 1.445 -3.751 1.00 0.87 H new ATOM 0 HG23 VAL C 110 14.359 1.060 -4.532 1.00 0.87 H new ATOM 1586 N LYS C 111 14.109 4.581 -7.218 1.00 0.73 N ATOM 1587 CA LYS C 111 14.846 5.273 -8.270 1.00 0.83 C ATOM 1588 C LYS C 111 16.208 4.615 -8.481 1.00 0.85 C ATOM 1589 O LYS C 111 16.482 4.061 -9.545 1.00 0.93 O ATOM 1590 CB LYS C 111 15.021 6.751 -7.908 1.00 0.89 C ATOM 1591 CG LYS C 111 13.718 7.541 -7.906 1.00 0.89 C ATOM 1592 CD LYS C 111 13.882 8.893 -7.224 1.00 0.99 C ATOM 1593 CE LYS C 111 14.593 9.907 -8.109 1.00 1.22 C ATOM 1594 NZ LYS C 111 14.899 11.164 -7.372 1.00 1.41 N ATOM 0 H LYS C 111 13.979 5.126 -6.366 1.00 0.73 H new ATOM 0 HA LYS C 111 14.278 5.205 -9.198 1.00 0.83 H new ATOM 0 HB2 LYS C 111 15.480 6.822 -6.922 1.00 0.89 H new ATOM 0 HB3 LYS C 111 15.712 7.210 -8.615 1.00 0.89 H new ATOM 0 HG2 LYS C 111 13.380 7.689 -8.932 1.00 0.89 H new ATOM 0 HG3 LYS C 111 12.945 6.967 -7.395 1.00 0.89 H new ATOM 0 HD2 LYS C 111 12.901 9.280 -6.949 1.00 0.99 H new ATOM 0 HD3 LYS C 111 14.444 8.765 -6.299 1.00 0.99 H new ATOM 0 HE2 LYS C 111 15.518 9.473 -8.488 1.00 1.22 H new ATOM 0 HE3 LYS C 111 13.970 10.135 -8.974 1.00 1.22 H new ATOM 0 HZ1 LYS C 111 15.383 11.830 -8.007 1.00 1.41 H new ATOM 0 HZ2 LYS C 111 14.014 11.591 -7.032 1.00 1.41 H new ATOM 0 HZ3 LYS C 111 15.514 10.950 -6.561 1.00 1.41 H new ATOM 1608 N ASP C 112 17.052 4.669 -7.458 1.00 0.80 N ATOM 1609 CA ASP C 112 18.382 4.070 -7.521 1.00 0.83 C ATOM 1610 C ASP C 112 18.693 3.349 -6.217 1.00 0.79 C ATOM 1611 O ASP C 112 18.914 2.135 -6.195 1.00 0.80 O ATOM 1612 CB ASP C 112 19.445 5.143 -7.786 1.00 0.94 C ATOM 1613 CG ASP C 112 20.843 4.569 -7.939 1.00 0.96 C ATOM 1614 OD1 ASP C 112 21.486 4.253 -6.913 1.00 0.98 O ATOM 1615 OD2 ASP C 112 21.318 4.451 -9.087 1.00 1.16 O ATOM 0 H ASP C 112 16.839 5.124 -6.570 1.00 0.80 H new ATOM 0 HA ASP C 112 18.397 3.352 -8.341 1.00 0.83 H new ATOM 0 HB2 ASP C 112 19.182 5.691 -8.691 1.00 0.94 H new ATOM 0 HB3 ASP C 112 19.441 5.861 -6.966 1.00 0.94 H new ATOM 1620 N LYS C 113 18.695 4.113 -5.131 1.00 0.83 N ATOM 1621 CA LYS C 113 18.976 3.578 -3.805 1.00 0.85 C ATOM 1622 C LYS C 113 17.892 2.600 -3.356 1.00 0.74 C ATOM 1623 O LYS C 113 16.731 2.977 -3.177 1.00 0.73 O ATOM 1624 CB LYS C 113 19.102 4.726 -2.793 1.00 0.96 C ATOM 1625 CG LYS C 113 17.969 5.741 -2.874 1.00 0.99 C ATOM 1626 CD LYS C 113 18.138 6.864 -1.865 1.00 1.20 C ATOM 1627 CE LYS C 113 16.971 7.842 -1.916 1.00 1.15 C ATOM 1628 NZ LYS C 113 17.014 8.821 -0.797 1.00 1.42 N ATOM 0 H LYS C 113 18.503 5.115 -5.144 1.00 0.83 H new ATOM 0 HA LYS C 113 19.919 3.033 -3.854 1.00 0.85 H new ATOM 0 HB2 LYS C 113 19.133 4.309 -1.786 1.00 0.96 H new ATOM 0 HB3 LYS C 113 20.050 5.239 -2.955 1.00 0.96 H new ATOM 0 HG2 LYS C 113 17.929 6.160 -3.879 1.00 0.99 H new ATOM 0 HG3 LYS C 113 17.018 5.237 -2.700 1.00 0.99 H new ATOM 0 HD2 LYS C 113 18.219 6.444 -0.862 1.00 1.20 H new ATOM 0 HD3 LYS C 113 19.068 7.396 -2.064 1.00 1.20 H new ATOM 0 HE2 LYS C 113 16.987 8.376 -2.866 1.00 1.15 H new ATOM 0 HE3 LYS C 113 16.033 7.289 -1.878 1.00 1.15 H new ATOM 0 HZ1 LYS C 113 16.549 9.704 -1.090 1.00 1.42 H new ATOM 0 HZ2 LYS C 113 16.519 8.427 0.028 1.00 1.42 H new ATOM 0 HZ3 LYS C 113 18.004 9.018 -0.546 1.00 1.42 H new ATOM 1642 N VAL C 114 18.273 1.342 -3.191 1.00 0.73 N ATOM 1643 CA VAL C 114 17.339 0.317 -2.747 1.00 0.67 C ATOM 1644 C VAL C 114 17.384 0.194 -1.232 1.00 0.68 C ATOM 1645 O VAL C 114 18.424 -0.121 -0.649 1.00 0.86 O ATOM 1646 CB VAL C 114 17.616 -1.065 -3.384 1.00 0.72 C ATOM 1647 CG1 VAL C 114 16.703 -1.292 -4.576 1.00 0.69 C ATOM 1648 CG2 VAL C 114 19.071 -1.192 -3.802 1.00 0.85 C ATOM 0 H VAL C 114 19.222 1.006 -3.358 1.00 0.73 H new ATOM 0 HA VAL C 114 16.348 0.632 -3.073 1.00 0.67 H new ATOM 0 HB VAL C 114 17.411 -1.829 -2.634 1.00 0.72 H new ATOM 0 HG11 VAL C 114 16.911 -2.269 -5.013 1.00 0.69 H new ATOM 0 HG12 VAL C 114 15.663 -1.254 -4.251 1.00 0.69 H new ATOM 0 HG13 VAL C 114 16.879 -0.517 -5.322 1.00 0.69 H new ATOM 0 HG21 VAL C 114 19.238 -2.173 -4.247 1.00 0.85 H new ATOM 0 HG22 VAL C 114 19.309 -0.418 -4.532 1.00 0.85 H new ATOM 0 HG23 VAL C 114 19.712 -1.076 -2.928 1.00 0.85 H new ATOM 1658 N TYR C 115 16.254 0.467 -0.604 1.00 0.64 N ATOM 1659 CA TYR C 115 16.140 0.408 0.847 1.00 0.63 C ATOM 1660 C TYR C 115 15.968 -1.029 1.328 1.00 0.64 C ATOM 1661 O TYR C 115 16.003 -1.972 0.543 1.00 0.91 O ATOM 1662 CB TYR C 115 14.938 1.233 1.311 1.00 0.63 C ATOM 1663 CG TYR C 115 15.099 2.729 1.153 1.00 0.69 C ATOM 1664 CD1 TYR C 115 14.996 3.336 -0.093 1.00 0.85 C ATOM 1665 CD2 TYR C 115 15.342 3.534 2.256 1.00 0.85 C ATOM 1666 CE1 TYR C 115 15.140 4.704 -0.233 1.00 0.93 C ATOM 1667 CE2 TYR C 115 15.486 4.899 2.123 1.00 0.99 C ATOM 1668 CZ TYR C 115 15.385 5.480 0.880 1.00 0.93 C ATOM 1669 OH TYR C 115 15.529 6.842 0.752 1.00 1.09 O ATOM 0 H TYR C 115 15.393 0.735 -1.080 1.00 0.64 H new ATOM 0 HA TYR C 115 17.059 0.814 1.270 1.00 0.63 H new ATOM 0 HB2 TYR C 115 14.058 0.915 0.751 1.00 0.63 H new ATOM 0 HB3 TYR C 115 14.746 1.011 2.361 1.00 0.63 H new ATOM 0 HD1 TYR C 115 14.800 2.730 -0.965 1.00 0.85 H new ATOM 0 HD2 TYR C 115 15.420 3.085 3.235 1.00 0.85 H new ATOM 0 HE1 TYR C 115 15.061 5.162 -1.208 1.00 0.93 H new ATOM 0 HE2 TYR C 115 15.678 5.510 2.992 1.00 0.99 H new ATOM 0 HH TYR C 115 15.696 7.238 1.633 1.00 1.09 H new ATOM 1679 N HIS C 116 15.781 -1.182 2.626 1.00 0.56 N ATOM 1680 CA HIS C 116 15.563 -2.491 3.221 1.00 0.54 C ATOM 1681 C HIS C 116 14.089 -2.631 3.567 1.00 0.51 C ATOM 1682 O HIS C 116 13.375 -1.634 3.611 1.00 0.50 O ATOM 1683 CB HIS C 116 16.413 -2.663 4.482 1.00 0.57 C ATOM 1684 CG HIS C 116 17.836 -3.037 4.210 1.00 0.61 C ATOM 1685 ND1 HIS C 116 18.912 -2.259 4.576 1.00 0.63 N ATOM 1686 CD2 HIS C 116 18.358 -4.134 3.612 1.00 0.67 C ATOM 1687 CE1 HIS C 116 20.031 -2.861 4.217 1.00 0.68 C ATOM 1688 NE2 HIS C 116 19.725 -4.007 3.630 1.00 0.71 N ATOM 0 H HIS C 116 15.776 -0.411 3.294 1.00 0.56 H new ATOM 0 HA HIS C 116 15.856 -3.262 2.509 1.00 0.54 H new ATOM 0 HB2 HIS C 116 16.395 -1.733 5.050 1.00 0.57 H new ATOM 0 HB3 HIS C 116 15.960 -3.429 5.111 1.00 0.57 H new ATOM 0 HD2 HIS C 116 17.800 -4.960 3.196 1.00 0.67 H new ATOM 0 HE1 HIS C 116 21.030 -2.481 4.376 1.00 0.68 H new ATOM 0 HE2 HIS C 116 20.392 -4.682 3.255 1.00 0.71 H new ATOM 1696 N LEU C 117 13.631 -3.852 3.817 1.00 0.53 N ATOM 1697 CA LEU C 117 12.231 -4.082 4.169 1.00 0.54 C ATOM 1698 C LEU C 117 11.865 -3.339 5.458 1.00 0.54 C ATOM 1699 O LEU C 117 10.722 -2.932 5.654 1.00 0.61 O ATOM 1700 CB LEU C 117 11.955 -5.584 4.317 1.00 0.60 C ATOM 1701 CG LEU C 117 12.912 -6.345 5.237 1.00 0.71 C ATOM 1702 CD1 LEU C 117 12.282 -6.565 6.601 1.00 0.90 C ATOM 1703 CD2 LEU C 117 13.296 -7.675 4.612 1.00 1.03 C ATOM 0 H LEU C 117 14.204 -4.695 3.783 1.00 0.53 H new ATOM 0 HA LEU C 117 11.608 -3.693 3.364 1.00 0.54 H new ATOM 0 HB2 LEU C 117 10.940 -5.713 4.692 1.00 0.60 H new ATOM 0 HB3 LEU C 117 11.990 -6.041 3.328 1.00 0.60 H new ATOM 0 HG LEU C 117 13.813 -5.746 5.368 1.00 0.71 H new ATOM 0 HD11 LEU C 117 12.978 -7.108 7.240 1.00 0.90 H new ATOM 0 HD12 LEU C 117 12.049 -5.601 7.054 1.00 0.90 H new ATOM 0 HD13 LEU C 117 11.365 -7.144 6.489 1.00 0.90 H new ATOM 0 HD21 LEU C 117 13.977 -8.206 5.277 1.00 1.03 H new ATOM 0 HD22 LEU C 117 12.400 -8.276 4.455 1.00 1.03 H new ATOM 0 HD23 LEU C 117 13.787 -7.499 3.655 1.00 1.03 H new ATOM 1715 N GLU C 118 12.854 -3.162 6.326 1.00 0.52 N ATOM 1716 CA GLU C 118 12.657 -2.469 7.593 1.00 0.55 C ATOM 1717 C GLU C 118 12.949 -0.973 7.456 1.00 0.52 C ATOM 1718 O GLU C 118 12.382 -0.144 8.173 1.00 0.54 O ATOM 1719 CB GLU C 118 13.573 -3.073 8.657 1.00 0.63 C ATOM 1720 CG GLU C 118 15.011 -3.237 8.188 1.00 0.60 C ATOM 1721 CD GLU C 118 15.957 -3.580 9.315 1.00 0.81 C ATOM 1722 OE1 GLU C 118 16.076 -4.776 9.644 1.00 1.05 O ATOM 1723 OE2 GLU C 118 16.584 -2.657 9.878 1.00 1.47 O ATOM 0 H GLU C 118 13.807 -3.492 6.173 1.00 0.52 H new ATOM 0 HA GLU C 118 11.615 -2.589 7.889 1.00 0.55 H new ATOM 0 HB2 GLU C 118 13.557 -2.439 9.543 1.00 0.63 H new ATOM 0 HB3 GLU C 118 13.182 -4.046 8.954 1.00 0.63 H new ATOM 0 HG2 GLU C 118 15.055 -4.020 7.431 1.00 0.60 H new ATOM 0 HG3 GLU C 118 15.341 -2.314 7.711 1.00 0.60 H new ATOM 1730 N CYS C 119 13.829 -0.635 6.521 1.00 0.52 N ATOM 1731 CA CYS C 119 14.227 0.746 6.293 1.00 0.52 C ATOM 1732 C CYS C 119 13.226 1.486 5.404 1.00 0.49 C ATOM 1733 O CYS C 119 13.215 2.713 5.363 1.00 0.72 O ATOM 1734 CB CYS C 119 15.638 0.774 5.697 1.00 0.56 C ATOM 1735 SG CYS C 119 16.835 -0.199 6.673 1.00 0.60 S ATOM 0 H CYS C 119 14.284 -1.307 5.903 1.00 0.52 H new ATOM 0 HA CYS C 119 14.235 1.271 7.248 1.00 0.52 H new ATOM 0 HB2 CYS C 119 15.606 0.386 4.679 1.00 0.56 H new ATOM 0 HB3 CYS C 119 15.981 1.807 5.634 1.00 0.56 H new ATOM 0 HG CYS C 119 17.680 -0.777 5.872 1.00 0.60 H new ATOM 1740 N PHE C 120 12.377 0.741 4.713 1.00 0.43 N ATOM 1741 CA PHE C 120 11.377 1.343 3.842 1.00 0.37 C ATOM 1742 C PHE C 120 10.082 1.607 4.614 1.00 0.35 C ATOM 1743 O PHE C 120 9.185 0.761 4.656 1.00 0.43 O ATOM 1744 CB PHE C 120 11.105 0.441 2.633 1.00 0.38 C ATOM 1745 CG PHE C 120 10.524 1.166 1.450 1.00 0.37 C ATOM 1746 CD1 PHE C 120 11.338 1.905 0.607 1.00 0.45 C ATOM 1747 CD2 PHE C 120 9.168 1.102 1.179 1.00 0.44 C ATOM 1748 CE1 PHE C 120 10.812 2.569 -0.482 1.00 0.50 C ATOM 1749 CE2 PHE C 120 8.634 1.765 0.091 1.00 0.48 C ATOM 1750 CZ PHE C 120 9.457 2.499 -0.740 1.00 0.47 C ATOM 0 H PHE C 120 12.359 -0.279 4.737 1.00 0.43 H new ATOM 0 HA PHE C 120 11.764 2.296 3.482 1.00 0.37 H new ATOM 0 HB2 PHE C 120 12.037 -0.037 2.332 1.00 0.38 H new ATOM 0 HB3 PHE C 120 10.421 -0.354 2.931 1.00 0.38 H new ATOM 0 HD1 PHE C 120 12.398 1.962 0.805 1.00 0.45 H new ATOM 0 HD2 PHE C 120 8.521 0.528 1.825 1.00 0.44 H new ATOM 0 HE1 PHE C 120 11.458 3.142 -1.131 1.00 0.50 H new ATOM 0 HE2 PHE C 120 7.574 1.709 -0.109 1.00 0.48 H new ATOM 0 HZ PHE C 120 9.041 3.018 -1.591 1.00 0.47 H new ATOM 1760 N LYS C 121 9.998 2.778 5.238 1.00 0.34 N ATOM 1761 CA LYS C 121 8.821 3.160 6.007 1.00 0.35 C ATOM 1762 C LYS C 121 8.589 4.662 5.913 1.00 0.34 C ATOM 1763 O LYS C 121 9.529 5.422 5.674 1.00 0.37 O ATOM 1764 CB LYS C 121 8.978 2.737 7.471 1.00 0.41 C ATOM 1765 CG LYS C 121 10.285 3.192 8.105 1.00 0.50 C ATOM 1766 CD LYS C 121 10.471 2.589 9.490 1.00 0.87 C ATOM 1767 CE LYS C 121 11.851 2.891 10.057 1.00 1.03 C ATOM 1768 NZ LYS C 121 12.935 2.340 9.204 1.00 1.35 N ATOM 0 H LYS C 121 10.736 3.482 5.225 1.00 0.34 H new ATOM 0 HA LYS C 121 7.955 2.648 5.589 1.00 0.35 H new ATOM 0 HB2 LYS C 121 8.146 3.141 8.047 1.00 0.41 H new ATOM 0 HB3 LYS C 121 8.913 1.651 7.535 1.00 0.41 H new ATOM 0 HG2 LYS C 121 11.120 2.904 7.466 1.00 0.50 H new ATOM 0 HG3 LYS C 121 10.297 4.280 8.176 1.00 0.50 H new ATOM 0 HD2 LYS C 121 9.708 2.981 10.163 1.00 0.87 H new ATOM 0 HD3 LYS C 121 10.327 1.510 9.439 1.00 0.87 H new ATOM 0 HE2 LYS C 121 11.976 3.970 10.151 1.00 1.03 H new ATOM 0 HE3 LYS C 121 11.931 2.472 11.060 1.00 1.03 H new ATOM 0 HZ1 LYS C 121 13.756 2.101 9.797 1.00 1.35 H new ATOM 0 HZ2 LYS C 121 12.595 1.484 8.721 1.00 1.35 H new ATOM 0 HZ3 LYS C 121 13.214 3.049 8.496 1.00 1.35 H new ATOM 1782 N CYS C 122 7.340 5.075 6.097 1.00 0.33 N ATOM 1783 CA CYS C 122 6.972 6.482 6.027 1.00 0.32 C ATOM 1784 C CYS C 122 7.693 7.299 7.094 1.00 0.35 C ATOM 1785 O CYS C 122 7.853 6.861 8.237 1.00 0.39 O ATOM 1786 CB CYS C 122 5.459 6.636 6.190 1.00 0.32 C ATOM 1787 SG CYS C 122 4.834 8.334 5.964 1.00 0.35 S ATOM 0 H CYS C 122 6.560 4.449 6.297 1.00 0.33 H new ATOM 0 HA CYS C 122 7.274 6.859 5.050 1.00 0.32 H new ATOM 0 HB2 CYS C 122 4.962 5.983 5.473 1.00 0.32 H new ATOM 0 HB3 CYS C 122 5.178 6.290 7.185 1.00 0.32 H new ATOM 0 HG CYS C 122 3.648 8.293 5.433 1.00 0.35 H new ATOM 1792 N ALA C 123 8.115 8.488 6.709 1.00 0.37 N ATOM 1793 CA ALA C 123 8.813 9.389 7.607 1.00 0.42 C ATOM 1794 C ALA C 123 7.839 10.129 8.515 1.00 0.46 C ATOM 1795 O ALA C 123 8.247 10.744 9.502 1.00 0.54 O ATOM 1796 CB ALA C 123 9.649 10.380 6.810 1.00 0.45 C ATOM 0 H ALA C 123 7.984 8.856 5.767 1.00 0.37 H new ATOM 0 HA ALA C 123 9.472 8.793 8.238 1.00 0.42 H new ATOM 0 HB1 ALA C 123 10.168 11.051 7.494 1.00 0.45 H new ATOM 0 HB2 ALA C 123 10.379 9.839 6.208 1.00 0.45 H new ATOM 0 HB3 ALA C 123 8.999 10.961 6.156 1.00 0.45 H new ATOM 1802 N ALA C 124 6.552 10.058 8.198 1.00 0.41 N ATOM 1803 CA ALA C 124 5.547 10.745 8.992 1.00 0.46 C ATOM 1804 C ALA C 124 4.757 9.788 9.880 1.00 0.47 C ATOM 1805 O ALA C 124 4.920 9.798 11.102 1.00 0.56 O ATOM 1806 CB ALA C 124 4.613 11.532 8.089 1.00 0.47 C ATOM 0 H ALA C 124 6.184 9.536 7.403 1.00 0.41 H new ATOM 0 HA ALA C 124 6.070 11.435 9.655 1.00 0.46 H new ATOM 0 HB1 ALA C 124 3.865 12.042 8.696 1.00 0.47 H new ATOM 0 HB2 ALA C 124 5.186 12.268 7.525 1.00 0.47 H new ATOM 0 HB3 ALA C 124 4.117 10.851 7.397 1.00 0.47 H new ATOM 1812 N CYS C 125 3.922 8.949 9.274 1.00 0.43 N ATOM 1813 CA CYS C 125 3.095 8.027 10.042 1.00 0.45 C ATOM 1814 C CYS C 125 3.812 6.705 10.322 1.00 0.43 C ATOM 1815 O CYS C 125 3.421 5.968 11.231 1.00 0.46 O ATOM 1816 CB CYS C 125 1.759 7.783 9.327 1.00 0.45 C ATOM 1817 SG CYS C 125 1.864 6.793 7.800 1.00 0.41 S ATOM 0 H CYS C 125 3.801 8.889 8.263 1.00 0.43 H new ATOM 0 HA CYS C 125 2.897 8.493 11.008 1.00 0.45 H new ATOM 0 HB2 CYS C 125 1.081 7.283 10.019 1.00 0.45 H new ATOM 0 HB3 CYS C 125 1.313 8.748 9.085 1.00 0.45 H new ATOM 0 HG CYS C 125 0.897 7.128 6.998 1.00 0.41 H new ATOM 1822 N GLN C 126 4.849 6.416 9.531 1.00 0.40 N ATOM 1823 CA GLN C 126 5.650 5.190 9.675 1.00 0.40 C ATOM 1824 C GLN C 126 4.843 3.934 9.356 1.00 0.40 C ATOM 1825 O GLN C 126 5.239 2.829 9.731 1.00 0.56 O ATOM 1826 CB GLN C 126 6.231 5.067 11.089 1.00 0.49 C ATOM 1827 CG GLN C 126 7.638 5.622 11.245 1.00 0.53 C ATOM 1828 CD GLN C 126 7.648 7.038 11.777 1.00 0.57 C ATOM 1829 OE1 GLN C 126 7.628 7.258 12.988 1.00 0.71 O ATOM 1830 NE2 GLN C 126 7.683 8.001 10.878 1.00 0.52 N ATOM 0 H GLN C 126 5.159 7.023 8.772 1.00 0.40 H new ATOM 0 HA GLN C 126 6.463 5.272 8.954 1.00 0.40 H new ATOM 0 HB2 GLN C 126 5.571 5.585 11.785 1.00 0.49 H new ATOM 0 HB3 GLN C 126 6.235 4.015 11.376 1.00 0.49 H new ATOM 0 HG2 GLN C 126 8.205 4.980 11.919 1.00 0.53 H new ATOM 0 HG3 GLN C 126 8.144 5.597 10.280 1.00 0.53 H new ATOM 0 HE21 GLN C 126 7.699 7.771 9.884 1.00 0.52 H new ATOM 0 HE22 GLN C 126 7.695 8.976 11.176 1.00 0.52 H new ATOM 1839 N LYS C 127 3.724 4.085 8.667 1.00 0.39 N ATOM 1840 CA LYS C 127 2.902 2.934 8.329 1.00 0.41 C ATOM 1841 C LYS C 127 3.463 2.224 7.106 1.00 0.37 C ATOM 1842 O LYS C 127 4.074 2.851 6.240 1.00 0.41 O ATOM 1843 CB LYS C 127 1.447 3.336 8.068 1.00 0.44 C ATOM 1844 CG LYS C 127 0.772 4.039 9.239 1.00 0.60 C ATOM 1845 CD LYS C 127 0.932 3.270 10.542 1.00 0.93 C ATOM 1846 CE LYS C 127 0.220 3.971 11.689 1.00 1.17 C ATOM 1847 NZ LYS C 127 0.540 5.424 11.736 1.00 1.58 N ATOM 0 H LYS C 127 3.367 4.981 8.334 1.00 0.39 H new ATOM 0 HA LYS C 127 2.920 2.258 9.184 1.00 0.41 H new ATOM 0 HB2 LYS C 127 1.414 3.991 7.198 1.00 0.44 H new ATOM 0 HB3 LYS C 127 0.875 2.443 7.817 1.00 0.44 H new ATOM 0 HG2 LYS C 127 1.195 5.037 9.354 1.00 0.60 H new ATOM 0 HG3 LYS C 127 -0.289 4.166 9.022 1.00 0.60 H new ATOM 0 HD2 LYS C 127 0.532 2.263 10.424 1.00 0.93 H new ATOM 0 HD3 LYS C 127 1.991 3.166 10.778 1.00 0.93 H new ATOM 0 HE2 LYS C 127 -0.857 3.840 11.582 1.00 1.17 H new ATOM 0 HE3 LYS C 127 0.506 3.506 12.632 1.00 1.17 H new ATOM 0 HZ1 LYS C 127 0.412 5.776 12.706 1.00 1.58 H new ATOM 0 HZ2 LYS C 127 1.526 5.572 11.441 1.00 1.58 H new ATOM 0 HZ3 LYS C 127 -0.094 5.940 11.094 1.00 1.58 H new ATOM 1861 N HIS C 128 3.277 0.909 7.061 1.00 0.40 N ATOM 1862 CA HIS C 128 3.745 0.100 5.940 1.00 0.41 C ATOM 1863 C HIS C 128 3.108 0.579 4.639 1.00 0.39 C ATOM 1864 O HIS C 128 1.935 0.965 4.618 1.00 0.39 O ATOM 1865 CB HIS C 128 3.420 -1.384 6.166 1.00 0.51 C ATOM 1866 CG HIS C 128 1.954 -1.691 6.167 1.00 0.56 C ATOM 1867 ND1 HIS C 128 1.273 -2.128 5.052 1.00 0.68 N ATOM 1868 CD2 HIS C 128 1.035 -1.598 7.153 1.00 0.64 C ATOM 1869 CE1 HIS C 128 0.000 -2.290 5.355 1.00 0.78 C ATOM 1870 NE2 HIS C 128 -0.173 -1.974 6.627 1.00 0.76 N ATOM 0 H HIS C 128 2.803 0.378 7.792 1.00 0.40 H new ATOM 0 HA HIS C 128 4.827 0.212 5.869 1.00 0.41 H new ATOM 0 HB2 HIS C 128 3.904 -1.974 5.388 1.00 0.51 H new ATOM 0 HB3 HIS C 128 3.848 -1.699 7.118 1.00 0.51 H new ATOM 0 HD2 HIS C 128 1.219 -1.285 8.170 1.00 0.64 H new ATOM 0 HE1 HIS C 128 -0.772 -2.625 4.678 1.00 0.78 H new ATOM 0 HE2 HIS C 128 -1.058 -2.005 7.133 1.00 0.76 H new ATOM 1879 N PHE C 129 3.872 0.528 3.560 1.00 0.39 N ATOM 1880 CA PHE C 129 3.386 0.969 2.259 1.00 0.39 C ATOM 1881 C PHE C 129 2.468 -0.069 1.613 1.00 0.48 C ATOM 1882 O PHE C 129 2.233 -1.151 2.167 1.00 0.56 O ATOM 1883 CB PHE C 129 4.563 1.285 1.333 1.00 0.37 C ATOM 1884 CG PHE C 129 5.185 2.626 1.602 1.00 0.28 C ATOM 1885 CD1 PHE C 129 6.091 2.790 2.638 1.00 0.37 C ATOM 1886 CD2 PHE C 129 4.854 3.726 0.828 1.00 0.21 C ATOM 1887 CE1 PHE C 129 6.658 4.022 2.895 1.00 0.40 C ATOM 1888 CE2 PHE C 129 5.418 4.961 1.080 1.00 0.23 C ATOM 1889 CZ PHE C 129 6.319 5.111 2.117 1.00 0.33 C ATOM 0 H PHE C 129 4.833 0.185 3.558 1.00 0.39 H new ATOM 0 HA PHE C 129 2.800 1.874 2.416 1.00 0.39 H new ATOM 0 HB2 PHE C 129 5.322 0.511 1.444 1.00 0.37 H new ATOM 0 HB3 PHE C 129 4.222 1.251 0.298 1.00 0.37 H new ATOM 0 HD1 PHE C 129 6.357 1.943 3.252 1.00 0.37 H new ATOM 0 HD2 PHE C 129 4.147 3.617 0.019 1.00 0.21 H new ATOM 0 HE1 PHE C 129 7.366 4.134 3.703 1.00 0.40 H new ATOM 0 HE2 PHE C 129 5.155 5.810 0.466 1.00 0.23 H new ATOM 0 HZ PHE C 129 6.757 6.078 2.318 1.00 0.33 H new ATOM 1899 N SER C 130 1.944 0.280 0.447 1.00 0.54 N ATOM 1900 CA SER C 130 1.054 -0.591 -0.299 1.00 0.69 C ATOM 1901 C SER C 130 1.635 -0.841 -1.688 1.00 0.60 C ATOM 1902 O SER C 130 2.582 -0.168 -2.099 1.00 0.80 O ATOM 1903 CB SER C 130 -0.338 0.046 -0.403 1.00 0.87 C ATOM 1904 OG SER C 130 -1.277 -0.832 -1.004 1.00 1.44 O ATOM 0 H SER C 130 2.125 1.175 -0.007 1.00 0.54 H new ATOM 0 HA SER C 130 0.957 -1.544 0.221 1.00 0.69 H new ATOM 0 HB2 SER C 130 -0.686 0.324 0.592 1.00 0.87 H new ATOM 0 HB3 SER C 130 -0.274 0.965 -0.986 1.00 0.87 H new ATOM 0 HG SER C 130 -2.096 -0.338 -1.219 1.00 1.44 H new ATOM 1910 N VAL C 131 1.076 -1.805 -2.401 1.00 0.76 N ATOM 1911 CA VAL C 131 1.548 -2.132 -3.734 1.00 0.73 C ATOM 1912 C VAL C 131 0.581 -1.592 -4.790 1.00 0.65 C ATOM 1913 O VAL C 131 -0.635 -1.757 -4.681 1.00 0.73 O ATOM 1914 CB VAL C 131 1.751 -3.661 -3.907 1.00 0.94 C ATOM 1915 CG1 VAL C 131 0.470 -4.427 -3.604 1.00 1.06 C ATOM 1916 CG2 VAL C 131 2.262 -3.990 -5.304 1.00 0.96 C ATOM 0 H VAL C 131 0.294 -2.375 -2.078 1.00 0.76 H new ATOM 0 HA VAL C 131 2.518 -1.654 -3.871 1.00 0.73 H new ATOM 0 HB VAL C 131 2.506 -3.977 -3.187 1.00 0.94 H new ATOM 0 HG11 VAL C 131 0.645 -5.495 -3.734 1.00 1.06 H new ATOM 0 HG12 VAL C 131 0.164 -4.232 -2.576 1.00 1.06 H new ATOM 0 HG13 VAL C 131 -0.317 -4.103 -4.285 1.00 1.06 H new ATOM 0 HG21 VAL C 131 2.396 -5.068 -5.398 1.00 0.96 H new ATOM 0 HG22 VAL C 131 1.540 -3.648 -6.045 1.00 0.96 H new ATOM 0 HG23 VAL C 131 3.217 -3.490 -5.469 1.00 0.96 H new ATOM 1926 N GLY C 132 1.131 -0.921 -5.795 1.00 0.57 N ATOM 1927 CA GLY C 132 0.310 -0.359 -6.850 1.00 0.58 C ATOM 1928 C GLY C 132 -0.266 0.991 -6.469 1.00 0.52 C ATOM 1929 O GLY C 132 -1.333 1.377 -6.947 1.00 0.61 O ATOM 0 H GLY C 132 2.132 -0.756 -5.898 1.00 0.57 H new ATOM 0 HA2 GLY C 132 0.907 -0.255 -7.756 1.00 0.58 H new ATOM 0 HA3 GLY C 132 -0.503 -1.047 -7.081 1.00 0.58 H new ATOM 1933 N ASP C 133 0.438 1.704 -5.599 1.00 0.50 N ATOM 1934 CA ASP C 133 0.000 3.021 -5.148 1.00 0.49 C ATOM 1935 C ASP C 133 1.127 4.037 -5.302 1.00 0.40 C ATOM 1936 O ASP C 133 2.286 3.667 -5.511 1.00 0.37 O ATOM 1937 CB ASP C 133 -0.475 2.974 -3.691 1.00 0.51 C ATOM 1938 CG ASP C 133 -1.962 2.689 -3.576 1.00 0.73 C ATOM 1939 OD1 ASP C 133 -2.763 3.433 -4.185 1.00 0.85 O ATOM 1940 OD2 ASP C 133 -2.341 1.721 -2.877 1.00 1.06 O ATOM 0 H ASP C 133 1.318 1.392 -5.190 1.00 0.50 H new ATOM 0 HA ASP C 133 -0.840 3.329 -5.771 1.00 0.49 H new ATOM 0 HB2 ASP C 133 0.082 2.206 -3.155 1.00 0.51 H new ATOM 0 HB3 ASP C 133 -0.252 3.925 -3.208 1.00 0.51 H new ATOM 1945 N ARG C 134 0.789 5.315 -5.207 1.00 0.41 N ATOM 1946 CA ARG C 134 1.775 6.377 -5.353 1.00 0.37 C ATOM 1947 C ARG C 134 2.430 6.698 -4.016 1.00 0.31 C ATOM 1948 O ARG C 134 1.881 6.390 -2.958 1.00 0.31 O ATOM 1949 CB ARG C 134 1.135 7.633 -5.956 1.00 0.44 C ATOM 1950 CG ARG C 134 -0.082 8.133 -5.192 1.00 0.64 C ATOM 1951 CD ARG C 134 -1.296 8.298 -6.102 1.00 0.78 C ATOM 1952 NE ARG C 134 -1.566 7.095 -6.896 1.00 1.08 N ATOM 1953 CZ ARG C 134 -2.071 5.962 -6.400 1.00 1.74 C ATOM 1954 NH1 ARG C 134 -2.431 5.883 -5.124 1.00 2.09 N ATOM 1955 NH2 ARG C 134 -2.234 4.910 -7.192 1.00 2.18 N ATOM 0 H ARG C 134 -0.161 5.642 -5.029 1.00 0.41 H new ATOM 0 HA ARG C 134 2.550 6.026 -6.035 1.00 0.37 H new ATOM 0 HB2 ARG C 134 1.881 8.427 -5.992 1.00 0.44 H new ATOM 0 HB3 ARG C 134 0.844 7.422 -6.985 1.00 0.44 H new ATOM 0 HG2 ARG C 134 -0.321 7.433 -4.391 1.00 0.64 H new ATOM 0 HG3 ARG C 134 0.152 9.088 -4.722 1.00 0.64 H new ATOM 0 HD2 ARG C 134 -2.171 8.535 -5.497 1.00 0.78 H new ATOM 0 HD3 ARG C 134 -1.133 9.143 -6.771 1.00 0.78 H new ATOM 0 HE ARG C 134 -1.354 7.125 -7.893 1.00 1.08 H new ATOM 0 HH11 ARG C 134 -2.323 6.692 -4.513 1.00 2.09 H new ATOM 0 HH12 ARG C 134 -2.816 5.013 -4.756 1.00 2.09 H new ATOM 0 HH21 ARG C 134 -1.974 4.968 -8.177 1.00 2.18 H new ATOM 0 HH22 ARG C 134 -2.619 4.044 -6.816 1.00 2.18 H new ATOM 1969 N TYR C 135 3.603 7.311 -4.077 1.00 0.30 N ATOM 1970 CA TYR C 135 4.343 7.676 -2.881 1.00 0.29 C ATOM 1971 C TYR C 135 5.299 8.828 -3.179 1.00 0.31 C ATOM 1972 O TYR C 135 5.449 9.239 -4.333 1.00 0.37 O ATOM 1973 CB TYR C 135 5.128 6.468 -2.349 1.00 0.30 C ATOM 1974 CG TYR C 135 6.389 6.142 -3.131 1.00 0.34 C ATOM 1975 CD1 TYR C 135 6.329 5.773 -4.470 1.00 0.37 C ATOM 1976 CD2 TYR C 135 7.639 6.198 -2.523 1.00 0.42 C ATOM 1977 CE1 TYR C 135 7.476 5.474 -5.181 1.00 0.43 C ATOM 1978 CE2 TYR C 135 8.790 5.899 -3.230 1.00 0.49 C ATOM 1979 CZ TYR C 135 8.702 5.535 -4.557 1.00 0.48 C ATOM 1980 OH TYR C 135 9.843 5.236 -5.267 1.00 0.57 O ATOM 0 H TYR C 135 4.064 7.567 -4.950 1.00 0.30 H new ATOM 0 HA TYR C 135 3.632 7.997 -2.120 1.00 0.29 H new ATOM 0 HB2 TYR C 135 5.398 6.656 -1.310 1.00 0.30 H new ATOM 0 HB3 TYR C 135 4.475 5.595 -2.356 1.00 0.30 H new ATOM 0 HD1 TYR C 135 5.370 5.719 -4.963 1.00 0.37 H new ATOM 0 HD2 TYR C 135 7.712 6.479 -1.483 1.00 0.42 H new ATOM 0 HE1 TYR C 135 7.411 5.194 -6.222 1.00 0.43 H new ATOM 0 HE2 TYR C 135 9.753 5.950 -2.745 1.00 0.49 H new ATOM 0 HH TYR C 135 10.628 5.551 -4.772 1.00 0.57 H new ATOM 1990 N LEU C 136 5.933 9.343 -2.139 1.00 0.32 N ATOM 1991 CA LEU C 136 6.887 10.429 -2.289 1.00 0.40 C ATOM 1992 C LEU C 136 8.226 10.011 -1.695 1.00 0.41 C ATOM 1993 O LEU C 136 8.272 9.404 -0.625 1.00 0.48 O ATOM 1994 CB LEU C 136 6.373 11.699 -1.606 1.00 0.45 C ATOM 1995 CG LEU C 136 7.140 12.980 -1.948 1.00 0.55 C ATOM 1996 CD1 LEU C 136 7.019 13.303 -3.429 1.00 0.63 C ATOM 1997 CD2 LEU C 136 6.632 14.144 -1.110 1.00 0.63 C ATOM 0 H LEU C 136 5.804 9.025 -1.178 1.00 0.32 H new ATOM 0 HA LEU C 136 7.015 10.646 -3.350 1.00 0.40 H new ATOM 0 HB2 LEU C 136 5.326 11.839 -1.875 1.00 0.45 H new ATOM 0 HB3 LEU C 136 6.408 11.551 -0.527 1.00 0.45 H new ATOM 0 HG LEU C 136 8.193 12.817 -1.718 1.00 0.55 H new ATOM 0 HD11 LEU C 136 7.572 14.217 -3.648 1.00 0.63 H new ATOM 0 HD12 LEU C 136 7.429 12.481 -4.015 1.00 0.63 H new ATOM 0 HD13 LEU C 136 5.969 13.443 -3.686 1.00 0.63 H new ATOM 0 HD21 LEU C 136 7.188 15.046 -1.366 1.00 0.63 H new ATOM 0 HD22 LEU C 136 5.572 14.302 -1.311 1.00 0.63 H new ATOM 0 HD23 LEU C 136 6.772 13.919 -0.053 1.00 0.63 H new ATOM 2009 N LEU C 137 9.310 10.318 -2.388 1.00 0.42 N ATOM 2010 CA LEU C 137 10.638 9.957 -1.912 1.00 0.46 C ATOM 2011 C LEU C 137 11.442 11.202 -1.568 1.00 0.46 C ATOM 2012 O LEU C 137 11.653 12.072 -2.410 1.00 0.49 O ATOM 2013 CB LEU C 137 11.376 9.121 -2.964 1.00 0.55 C ATOM 2014 CG LEU C 137 12.862 8.860 -2.686 1.00 0.64 C ATOM 2015 CD1 LEU C 137 13.049 8.129 -1.367 1.00 1.16 C ATOM 2016 CD2 LEU C 137 13.477 8.060 -3.820 1.00 1.06 C ATOM 0 H LEU C 137 9.299 10.814 -3.279 1.00 0.42 H new ATOM 0 HA LEU C 137 10.526 9.359 -1.008 1.00 0.46 H new ATOM 0 HB2 LEU C 137 10.869 8.161 -3.059 1.00 0.55 H new ATOM 0 HB3 LEU C 137 11.289 9.624 -3.927 1.00 0.55 H new ATOM 0 HG LEU C 137 13.368 9.823 -2.617 1.00 0.64 H new ATOM 0 HD11 LEU C 137 14.111 7.956 -1.194 1.00 1.16 H new ATOM 0 HD12 LEU C 137 12.643 8.733 -0.556 1.00 1.16 H new ATOM 0 HD13 LEU C 137 12.527 7.173 -1.404 1.00 1.16 H new ATOM 0 HD21 LEU C 137 14.532 7.882 -3.610 1.00 1.06 H new ATOM 0 HD22 LEU C 137 12.960 7.105 -3.914 1.00 1.06 H new ATOM 0 HD23 LEU C 137 13.382 8.617 -4.752 1.00 1.06 H new ATOM 2028 N ILE C 138 11.879 11.287 -0.325 1.00 0.49 N ATOM 2029 CA ILE C 138 12.668 12.415 0.132 1.00 0.54 C ATOM 2030 C ILE C 138 14.125 11.984 0.278 1.00 0.58 C ATOM 2031 O ILE C 138 14.439 10.796 0.170 1.00 0.73 O ATOM 2032 CB ILE C 138 12.136 12.970 1.480 1.00 0.53 C ATOM 2033 CG1 ILE C 138 10.600 13.000 1.479 1.00 0.61 C ATOM 2034 CG2 ILE C 138 12.695 14.362 1.756 1.00 0.64 C ATOM 2035 CD1 ILE C 138 10.009 14.028 0.537 1.00 0.77 C ATOM 0 H ILE C 138 11.699 10.583 0.390 1.00 0.49 H new ATOM 0 HA ILE C 138 12.591 13.213 -0.606 1.00 0.54 H new ATOM 0 HB ILE C 138 12.472 12.306 2.276 1.00 0.53 H new ATOM 0 HG12 ILE C 138 10.227 12.013 1.205 1.00 0.61 H new ATOM 0 HG13 ILE C 138 10.249 13.204 2.491 1.00 0.61 H new ATOM 0 HG21 ILE C 138 12.307 14.728 2.706 1.00 0.64 H new ATOM 0 HG22 ILE C 138 13.783 14.315 1.803 1.00 0.64 H new ATOM 0 HG23 ILE C 138 12.395 15.040 0.956 1.00 0.64 H new ATOM 0 HD11 ILE C 138 8.921 13.989 0.592 1.00 0.77 H new ATOM 0 HD12 ILE C 138 10.351 15.023 0.823 1.00 0.77 H new ATOM 0 HD13 ILE C 138 10.329 13.813 -0.483 1.00 0.77 H new ATOM 2047 N ASN C 139 15.014 12.941 0.494 1.00 0.70 N ATOM 2048 CA ASN C 139 16.432 12.644 0.652 1.00 0.73 C ATOM 2049 C ASN C 139 16.668 11.787 1.891 1.00 0.66 C ATOM 2050 O ASN C 139 17.516 10.897 1.884 1.00 0.84 O ATOM 2051 CB ASN C 139 17.246 13.939 0.751 1.00 0.90 C ATOM 2052 CG ASN C 139 17.049 14.849 -0.446 1.00 1.04 C ATOM 2053 OD1 ASN C 139 16.742 14.398 -1.553 1.00 1.12 O ATOM 2054 ND2 ASN C 139 17.225 16.142 -0.231 1.00 1.32 N ATOM 0 H ASN C 139 14.780 13.931 0.564 1.00 0.70 H new ATOM 0 HA ASN C 139 16.760 12.088 -0.226 1.00 0.73 H new ATOM 0 HB2 ASN C 139 16.962 14.473 1.658 1.00 0.90 H new ATOM 0 HB3 ASN C 139 18.304 13.692 0.844 1.00 0.90 H new ATOM 0 HD21 ASN C 139 17.107 16.807 -0.996 1.00 1.32 H new ATOM 0 HD22 ASN C 139 17.478 16.474 0.699 1.00 1.32 H new ATOM 2061 N SER C 140 15.911 12.054 2.948 1.00 0.57 N ATOM 2062 CA SER C 140 16.045 11.308 4.189 1.00 0.61 C ATOM 2063 C SER C 140 15.326 9.957 4.112 1.00 0.54 C ATOM 2064 O SER C 140 15.966 8.906 4.132 1.00 0.68 O ATOM 2065 CB SER C 140 15.489 12.138 5.344 1.00 0.76 C ATOM 2066 OG SER C 140 15.673 13.523 5.098 1.00 1.04 O ATOM 0 H SER C 140 15.198 12.783 2.969 1.00 0.57 H new ATOM 0 HA SER C 140 17.103 11.108 4.357 1.00 0.61 H new ATOM 0 HB2 SER C 140 14.428 11.924 5.475 1.00 0.76 H new ATOM 0 HB3 SER C 140 15.987 11.859 6.272 1.00 0.76 H new ATOM 0 HG SER C 140 15.309 14.039 5.847 1.00 1.04 H new ATOM 2072 N ASP C 141 13.998 9.992 4.001 1.00 0.53 N ATOM 2073 CA ASP C 141 13.199 8.769 3.938 1.00 0.48 C ATOM 2074 C ASP C 141 12.053 8.922 2.943 1.00 0.41 C ATOM 2075 O ASP C 141 12.028 9.867 2.152 1.00 0.46 O ATOM 2076 CB ASP C 141 12.636 8.413 5.322 1.00 0.49 C ATOM 2077 CG ASP C 141 13.683 7.858 6.269 1.00 0.72 C ATOM 2078 OD1 ASP C 141 14.136 6.711 6.063 1.00 1.10 O ATOM 2079 OD2 ASP C 141 14.043 8.557 7.240 1.00 1.06 O ATOM 0 H ASP C 141 13.454 10.853 3.953 1.00 0.53 H new ATOM 0 HA ASP C 141 13.852 7.963 3.604 1.00 0.48 H new ATOM 0 HB2 ASP C 141 12.190 9.303 5.765 1.00 0.49 H new ATOM 0 HB3 ASP C 141 11.837 7.681 5.205 1.00 0.49 H new ATOM 2084 N ILE C 142 11.103 7.998 2.992 1.00 0.37 N ATOM 2085 CA ILE C 142 9.955 8.022 2.089 1.00 0.32 C ATOM 2086 C ILE C 142 8.695 8.493 2.806 1.00 0.30 C ATOM 2087 O ILE C 142 8.646 8.527 4.034 1.00 0.32 O ATOM 2088 CB ILE C 142 9.673 6.636 1.455 1.00 0.31 C ATOM 2089 CG1 ILE C 142 9.903 5.501 2.472 1.00 0.37 C ATOM 2090 CG2 ILE C 142 10.523 6.437 0.210 1.00 0.38 C ATOM 2091 CD1 ILE C 142 11.334 4.987 2.539 1.00 0.45 C ATOM 0 H ILE C 142 11.103 7.218 3.650 1.00 0.37 H new ATOM 0 HA ILE C 142 10.215 8.724 1.296 1.00 0.32 H new ATOM 0 HB ILE C 142 8.624 6.604 1.160 1.00 0.31 H new ATOM 0 HG12 ILE C 142 9.611 5.854 3.461 1.00 0.37 H new ATOM 0 HG13 ILE C 142 9.244 4.669 2.223 1.00 0.37 H new ATOM 0 HG21 ILE C 142 10.312 5.459 -0.222 1.00 0.38 H new ATOM 0 HG22 ILE C 142 10.289 7.213 -0.518 1.00 0.38 H new ATOM 0 HG23 ILE C 142 11.578 6.496 0.477 1.00 0.38 H new ATOM 0 HD11 ILE C 142 11.400 4.191 3.281 1.00 0.45 H new ATOM 0 HD12 ILE C 142 11.627 4.600 1.563 1.00 0.45 H new ATOM 0 HD13 ILE C 142 12.001 5.802 2.821 1.00 0.45 H new ATOM 2103 N VAL C 143 7.690 8.861 2.023 1.00 0.29 N ATOM 2104 CA VAL C 143 6.416 9.335 2.552 1.00 0.28 C ATOM 2105 C VAL C 143 5.262 8.669 1.798 1.00 0.24 C ATOM 2106 O VAL C 143 5.351 8.452 0.583 1.00 0.23 O ATOM 2107 CB VAL C 143 6.292 10.875 2.423 1.00 0.34 C ATOM 2108 CG1 VAL C 143 4.984 11.370 3.015 1.00 0.37 C ATOM 2109 CG2 VAL C 143 7.469 11.572 3.089 1.00 0.45 C ATOM 0 H VAL C 143 7.734 8.840 1.004 1.00 0.29 H new ATOM 0 HA VAL C 143 6.371 9.072 3.609 1.00 0.28 H new ATOM 0 HB VAL C 143 6.301 11.119 1.361 1.00 0.34 H new ATOM 0 HG11 VAL C 143 4.924 12.453 2.911 1.00 0.37 H new ATOM 0 HG12 VAL C 143 4.149 10.908 2.489 1.00 0.37 H new ATOM 0 HG13 VAL C 143 4.939 11.104 4.071 1.00 0.37 H new ATOM 0 HG21 VAL C 143 7.359 12.651 2.985 1.00 0.45 H new ATOM 0 HG22 VAL C 143 7.496 11.310 4.147 1.00 0.45 H new ATOM 0 HG23 VAL C 143 8.397 11.254 2.613 1.00 0.45 H new ATOM 2119 N CYS C 144 4.194 8.335 2.518 1.00 0.23 N ATOM 2120 CA CYS C 144 3.035 7.695 1.911 1.00 0.21 C ATOM 2121 C CYS C 144 2.162 8.721 1.197 1.00 0.20 C ATOM 2122 O CYS C 144 2.447 9.916 1.219 1.00 0.32 O ATOM 2123 CB CYS C 144 2.205 6.970 2.975 1.00 0.26 C ATOM 2124 SG CYS C 144 1.333 8.079 4.134 1.00 0.32 S ATOM 0 H CYS C 144 4.109 8.498 3.521 1.00 0.23 H new ATOM 0 HA CYS C 144 3.396 6.970 1.182 1.00 0.21 H new ATOM 0 HB2 CYS C 144 1.472 6.336 2.477 1.00 0.26 H new ATOM 0 HB3 CYS C 144 2.861 6.312 3.545 1.00 0.26 H new ATOM 0 HG CYS C 144 0.634 7.370 4.970 1.00 0.32 H new ATOM 2129 N GLU C 145 1.089 8.253 0.573 1.00 0.21 N ATOM 2130 CA GLU C 145 0.177 9.145 -0.125 1.00 0.22 C ATOM 2131 C GLU C 145 -0.945 9.575 0.817 1.00 0.26 C ATOM 2132 O GLU C 145 -1.770 10.426 0.483 1.00 0.28 O ATOM 2133 CB GLU C 145 -0.404 8.479 -1.377 1.00 0.25 C ATOM 2134 CG GLU C 145 -1.398 7.365 -1.086 1.00 0.29 C ATOM 2135 CD GLU C 145 -2.602 7.405 -2.008 1.00 0.49 C ATOM 2136 OE1 GLU C 145 -2.435 7.721 -3.205 1.00 0.95 O ATOM 2137 OE2 GLU C 145 -3.725 7.118 -1.546 1.00 0.59 O ATOM 0 H GLU C 145 0.831 7.267 0.537 1.00 0.21 H new ATOM 0 HA GLU C 145 0.735 10.024 -0.446 1.00 0.22 H new ATOM 0 HB2 GLU C 145 -0.895 9.239 -1.985 1.00 0.25 H new ATOM 0 HB3 GLU C 145 0.414 8.074 -1.973 1.00 0.25 H new ATOM 0 HG2 GLU C 145 -0.899 6.401 -1.187 1.00 0.29 H new ATOM 0 HG3 GLU C 145 -1.734 7.443 -0.052 1.00 0.29 H new ATOM 2144 N GLN C 146 -0.947 8.989 2.008 1.00 0.31 N ATOM 2145 CA GLN C 146 -1.959 9.288 3.008 1.00 0.38 C ATOM 2146 C GLN C 146 -1.658 10.617 3.692 1.00 0.38 C ATOM 2147 O GLN C 146 -2.552 11.447 3.872 1.00 0.46 O ATOM 2148 CB GLN C 146 -2.036 8.153 4.037 1.00 0.44 C ATOM 2149 CG GLN C 146 -2.531 8.590 5.410 1.00 0.67 C ATOM 2150 CD GLN C 146 -1.870 7.830 6.545 1.00 0.83 C ATOM 2151 OE1 GLN C 146 -0.618 7.452 6.358 1.00 0.86 O flip ATOM 2152 NE2 GLN C 146 -2.484 7.590 7.585 1.00 1.34 N flip ATOM 0 H GLN C 146 -0.255 8.301 2.304 1.00 0.31 H new ATOM 0 HA GLN C 146 -2.926 9.373 2.513 1.00 0.38 H new ATOM 0 HB2 GLN C 146 -2.697 7.375 3.655 1.00 0.44 H new ATOM 0 HB3 GLN C 146 -1.047 7.707 4.144 1.00 0.44 H new ATOM 0 HG2 GLN C 146 -2.344 9.656 5.536 1.00 0.67 H new ATOM 0 HG3 GLN C 146 -3.610 8.447 5.464 1.00 0.67 H new ATOM 0 HE21 GLN C 146 -3.450 7.899 7.690 1.00 1.34 H new ATOM 0 HE22 GLN C 146 -2.026 7.082 8.342 1.00 1.34 H new ATOM 2161 N ASP C 147 -0.402 10.829 4.052 1.00 0.33 N ATOM 2162 CA ASP C 147 -0.011 12.064 4.719 1.00 0.35 C ATOM 2163 C ASP C 147 0.930 12.886 3.841 1.00 0.33 C ATOM 2164 O ASP C 147 1.547 13.846 4.303 1.00 0.38 O ATOM 2165 CB ASP C 147 0.620 11.773 6.099 1.00 0.40 C ATOM 2166 CG ASP C 147 1.898 10.939 6.051 1.00 0.38 C ATOM 2167 OD1 ASP C 147 2.816 11.304 5.294 1.00 0.38 O ATOM 2168 OD2 ASP C 147 1.994 9.948 6.824 1.00 0.40 O ATOM 0 H ASP C 147 0.360 10.169 3.896 1.00 0.33 H new ATOM 0 HA ASP C 147 -0.911 12.656 4.885 1.00 0.35 H new ATOM 0 HB2 ASP C 147 0.839 12.721 6.591 1.00 0.40 H new ATOM 0 HB3 ASP C 147 -0.113 11.255 6.717 1.00 0.40 H new ATOM 2173 N ILE C 148 0.998 12.529 2.560 1.00 0.29 N ATOM 2174 CA ILE C 148 1.867 13.224 1.609 1.00 0.30 C ATOM 2175 C ILE C 148 1.539 14.716 1.507 1.00 0.33 C ATOM 2176 O ILE C 148 2.443 15.552 1.458 1.00 0.38 O ATOM 2177 CB ILE C 148 1.805 12.587 0.197 1.00 0.28 C ATOM 2178 CG1 ILE C 148 2.824 13.250 -0.738 1.00 0.35 C ATOM 2179 CG2 ILE C 148 0.404 12.678 -0.391 1.00 0.26 C ATOM 2180 CD1 ILE C 148 2.847 12.655 -2.133 1.00 0.65 C ATOM 0 H ILE C 148 0.462 11.762 2.155 1.00 0.29 H new ATOM 0 HA ILE C 148 2.879 13.118 2.000 1.00 0.30 H new ATOM 0 HB ILE C 148 2.058 11.531 0.297 1.00 0.28 H new ATOM 0 HG12 ILE C 148 2.600 14.314 -0.810 1.00 0.35 H new ATOM 0 HG13 ILE C 148 3.818 13.163 -0.299 1.00 0.35 H new ATOM 0 HG21 ILE C 148 0.395 12.222 -1.381 1.00 0.26 H new ATOM 0 HG22 ILE C 148 -0.297 12.152 0.257 1.00 0.26 H new ATOM 0 HG23 ILE C 148 0.110 13.725 -0.470 1.00 0.26 H new ATOM 0 HD11 ILE C 148 3.591 13.174 -2.738 1.00 0.65 H new ATOM 0 HD12 ILE C 148 3.102 11.597 -2.073 1.00 0.65 H new ATOM 0 HD13 ILE C 148 1.865 12.766 -2.592 1.00 0.65 H new ATOM 2192 N TYR C 149 0.252 15.053 1.494 1.00 0.33 N ATOM 2193 CA TYR C 149 -0.163 16.445 1.388 1.00 0.38 C ATOM 2194 C TYR C 149 0.172 17.198 2.668 1.00 0.45 C ATOM 2195 O TYR C 149 0.404 18.404 2.649 1.00 0.52 O ATOM 2196 CB TYR C 149 -1.660 16.542 1.089 1.00 0.42 C ATOM 2197 CG TYR C 149 -2.052 17.819 0.375 1.00 0.51 C ATOM 2198 CD1 TYR C 149 -1.367 18.239 -0.760 1.00 0.61 C ATOM 2199 CD2 TYR C 149 -3.107 18.600 0.830 1.00 0.68 C ATOM 2200 CE1 TYR C 149 -1.718 19.404 -1.416 1.00 0.75 C ATOM 2201 CE2 TYR C 149 -3.464 19.766 0.177 1.00 0.79 C ATOM 2202 CZ TYR C 149 -2.768 20.161 -0.947 1.00 0.77 C ATOM 2203 OH TYR C 149 -3.114 21.324 -1.602 1.00 0.93 O ATOM 0 H TYR C 149 -0.516 14.384 1.555 1.00 0.33 H new ATOM 0 HA TYR C 149 0.382 16.902 0.562 1.00 0.38 H new ATOM 0 HB2 TYR C 149 -1.957 15.689 0.479 1.00 0.42 H new ATOM 0 HB3 TYR C 149 -2.215 16.473 2.025 1.00 0.42 H new ATOM 0 HD1 TYR C 149 -0.547 17.645 -1.135 1.00 0.61 H new ATOM 0 HD2 TYR C 149 -3.657 18.292 1.707 1.00 0.68 H new ATOM 0 HE1 TYR C 149 -1.171 19.719 -2.292 1.00 0.75 H new ATOM 0 HE2 TYR C 149 -4.284 20.365 0.545 1.00 0.79 H new ATOM 0 HH TYR C 149 -3.875 21.741 -1.147 1.00 0.93 H new ATOM 2213 N GLU C 150 0.207 16.479 3.776 1.00 0.49 N ATOM 2214 CA GLU C 150 0.535 17.080 5.055 1.00 0.59 C ATOM 2215 C GLU C 150 2.034 17.335 5.133 1.00 0.60 C ATOM 2216 O GLU C 150 2.471 18.431 5.485 1.00 0.70 O ATOM 2217 CB GLU C 150 0.092 16.173 6.205 1.00 0.66 C ATOM 2218 CG GLU C 150 -1.392 15.837 6.174 1.00 0.76 C ATOM 2219 CD GLU C 150 -2.131 16.341 7.396 1.00 1.13 C ATOM 2220 OE1 GLU C 150 -2.256 17.574 7.556 1.00 1.67 O ATOM 2221 OE2 GLU C 150 -2.600 15.510 8.195 1.00 1.48 O ATOM 0 H GLU C 150 0.012 15.479 3.815 1.00 0.49 H new ATOM 0 HA GLU C 150 0.005 18.028 5.144 1.00 0.59 H new ATOM 0 HB2 GLU C 150 0.667 15.248 6.170 1.00 0.66 H new ATOM 0 HB3 GLU C 150 0.327 16.659 7.152 1.00 0.66 H new ATOM 0 HG2 GLU C 150 -1.840 16.270 5.279 1.00 0.76 H new ATOM 0 HG3 GLU C 150 -1.514 14.756 6.101 1.00 0.76 H new ATOM 2228 N TRP C 151 2.808 16.316 4.775 1.00 0.52 N ATOM 2229 CA TRP C 151 4.263 16.397 4.793 1.00 0.54 C ATOM 2230 C TRP C 151 4.760 17.534 3.905 1.00 0.60 C ATOM 2231 O TRP C 151 5.630 18.312 4.307 1.00 0.68 O ATOM 2232 CB TRP C 151 4.863 15.066 4.325 1.00 0.46 C ATOM 2233 CG TRP C 151 6.353 14.979 4.494 1.00 0.50 C ATOM 2234 CD1 TRP C 151 7.309 15.244 3.551 1.00 0.55 C ATOM 2235 CD2 TRP C 151 7.060 14.584 5.676 1.00 0.56 C ATOM 2236 NE1 TRP C 151 8.562 15.052 4.082 1.00 0.63 N ATOM 2237 CE2 TRP C 151 8.434 14.646 5.384 1.00 0.63 C ATOM 2238 CE3 TRP C 151 6.661 14.197 6.956 1.00 0.62 C ATOM 2239 CZ2 TRP C 151 9.412 14.319 6.320 1.00 0.73 C ATOM 2240 CZ3 TRP C 151 7.633 13.875 7.886 1.00 0.73 C ATOM 2241 CH2 TRP C 151 8.994 13.943 7.566 1.00 0.77 C ATOM 0 H TRP C 151 2.446 15.414 4.465 1.00 0.52 H new ATOM 0 HA TRP C 151 4.583 16.600 5.815 1.00 0.54 H new ATOM 0 HB2 TRP C 151 4.396 14.253 4.880 1.00 0.46 H new ATOM 0 HB3 TRP C 151 4.617 14.917 3.274 1.00 0.46 H new ATOM 0 HD1 TRP C 151 7.108 15.558 2.537 1.00 0.55 H new ATOM 0 HE1 TRP C 151 9.443 15.189 3.587 1.00 0.63 H new ATOM 0 HE3 TRP C 151 5.614 14.150 7.215 1.00 0.62 H new ATOM 0 HZ2 TRP C 151 10.462 14.361 6.071 1.00 0.73 H new ATOM 0 HZ3 TRP C 151 7.336 13.565 8.877 1.00 0.73 H new ATOM 0 HH2 TRP C 151 9.728 13.694 8.318 1.00 0.77 H new ATOM 2252 N THR C 152 4.197 17.639 2.708 1.00 0.58 N ATOM 2253 CA THR C 152 4.598 18.673 1.765 1.00 0.65 C ATOM 2254 C THR C 152 4.309 20.071 2.306 1.00 0.75 C ATOM 2255 O THR C 152 5.181 20.937 2.293 1.00 0.85 O ATOM 2256 CB THR C 152 3.902 18.491 0.401 1.00 0.62 C ATOM 2257 OG1 THR C 152 2.552 18.048 0.594 1.00 0.53 O ATOM 2258 CG2 THR C 152 4.657 17.485 -0.456 1.00 0.60 C ATOM 0 H THR C 152 3.461 17.020 2.368 1.00 0.58 H new ATOM 0 HA THR C 152 5.674 18.570 1.627 1.00 0.65 H new ATOM 0 HB THR C 152 3.895 19.452 -0.113 1.00 0.62 H new ATOM 0 HG1 THR C 152 2.533 17.070 0.645 1.00 0.53 H new ATOM 0 HG21 THR C 152 4.150 17.370 -1.414 1.00 0.60 H new ATOM 0 HG22 THR C 152 5.674 17.840 -0.623 1.00 0.60 H new ATOM 0 HG23 THR C 152 4.688 16.523 0.055 1.00 0.60 H new ATOM 2266 N LYS C 153 3.094 20.284 2.792 1.00 0.77 N ATOM 2267 CA LYS C 153 2.706 21.584 3.332 1.00 0.87 C ATOM 2268 C LYS C 153 3.578 21.978 4.526 1.00 0.93 C ATOM 2269 O LYS C 153 4.053 23.112 4.610 1.00 1.04 O ATOM 2270 CB LYS C 153 1.236 21.577 3.751 1.00 0.87 C ATOM 2271 CG LYS C 153 0.257 21.511 2.584 1.00 0.83 C ATOM 2272 CD LYS C 153 -1.188 21.642 3.052 1.00 0.92 C ATOM 2273 CE LYS C 153 -1.566 20.538 4.032 1.00 0.90 C ATOM 2274 NZ LYS C 153 -2.878 20.790 4.683 1.00 1.14 N ATOM 0 H LYS C 153 2.360 19.577 2.824 1.00 0.77 H new ATOM 0 HA LYS C 153 2.852 22.320 2.541 1.00 0.87 H new ATOM 0 HB2 LYS C 153 1.060 20.725 4.407 1.00 0.87 H new ATOM 0 HB3 LYS C 153 1.031 22.475 4.333 1.00 0.87 H new ATOM 0 HG2 LYS C 153 0.483 22.307 1.874 1.00 0.83 H new ATOM 0 HG3 LYS C 153 0.384 20.566 2.055 1.00 0.83 H new ATOM 0 HD2 LYS C 153 -1.330 22.613 3.526 1.00 0.92 H new ATOM 0 HD3 LYS C 153 -1.854 21.607 2.190 1.00 0.92 H new ATOM 0 HE2 LYS C 153 -1.601 19.584 3.506 1.00 0.90 H new ATOM 0 HE3 LYS C 153 -0.794 20.453 4.796 1.00 0.90 H new ATOM 0 HZ1 LYS C 153 -3.094 20.014 5.341 1.00 1.14 H new ATOM 0 HZ2 LYS C 153 -2.839 21.687 5.207 1.00 1.14 H new ATOM 0 HZ3 LYS C 153 -3.621 20.845 3.957 1.00 1.14 H new ATOM 2288 N ILE C 154 3.795 21.037 5.437 1.00 0.88 N ATOM 2289 CA ILE C 154 4.599 21.287 6.631 1.00 0.95 C ATOM 2290 C ILE C 154 6.062 21.560 6.274 1.00 0.98 C ATOM 2291 O ILE C 154 6.700 22.438 6.861 1.00 1.10 O ATOM 2292 CB ILE C 154 4.513 20.096 7.613 1.00 0.91 C ATOM 2293 CG1 ILE C 154 3.072 19.924 8.106 1.00 0.91 C ATOM 2294 CG2 ILE C 154 5.455 20.294 8.791 1.00 1.02 C ATOM 2295 CD1 ILE C 154 2.845 18.665 8.918 1.00 0.90 C ATOM 0 H ILE C 154 3.424 20.089 5.372 1.00 0.88 H new ATOM 0 HA ILE C 154 4.192 22.175 7.114 1.00 0.95 H new ATOM 0 HB ILE C 154 4.817 19.192 7.085 1.00 0.91 H new ATOM 0 HG12 ILE C 154 2.800 20.789 8.712 1.00 0.91 H new ATOM 0 HG13 ILE C 154 2.403 19.915 7.245 1.00 0.91 H new ATOM 0 HG21 ILE C 154 5.376 19.443 9.467 1.00 1.02 H new ATOM 0 HG22 ILE C 154 6.480 20.375 8.428 1.00 1.02 H new ATOM 0 HG23 ILE C 154 5.185 21.206 9.323 1.00 1.02 H new ATOM 0 HD11 ILE C 154 1.802 18.616 9.230 1.00 0.90 H new ATOM 0 HD12 ILE C 154 3.083 17.792 8.310 1.00 0.90 H new ATOM 0 HD13 ILE C 154 3.487 18.680 9.799 1.00 0.90 H new ATOM 2307 N ASN C 155 6.587 20.823 5.303 1.00 0.93 N ATOM 2308 CA ASN C 155 7.980 20.991 4.889 1.00 0.96 C ATOM 2309 C ASN C 155 8.167 22.256 4.058 1.00 1.05 C ATOM 2310 O ASN C 155 9.200 22.924 4.154 1.00 1.16 O ATOM 2311 CB ASN C 155 8.462 19.768 4.107 1.00 0.90 C ATOM 2312 CG ASN C 155 8.989 18.678 5.019 1.00 0.86 C ATOM 2313 OD1 ASN C 155 10.193 18.571 5.252 1.00 1.13 O ATOM 2314 ND2 ASN C 155 8.090 17.865 5.545 1.00 0.90 N ATOM 0 H ASN C 155 6.075 20.106 4.788 1.00 0.93 H new ATOM 0 HA ASN C 155 8.581 21.090 5.793 1.00 0.96 H new ATOM 0 HB2 ASN C 155 7.640 19.374 3.509 1.00 0.90 H new ATOM 0 HB3 ASN C 155 9.246 20.069 3.412 1.00 0.90 H new ATOM 0 HD21 ASN C 155 8.385 17.115 6.170 1.00 0.90 H new ATOM 0 HD22 ASN C 155 7.101 17.988 5.326 1.00 0.90 H new ATOM 2321 N GLY C 156 7.169 22.587 3.248 1.00 1.07 N ATOM 2322 CA GLY C 156 7.253 23.780 2.425 1.00 1.18 C ATOM 2323 C GLY C 156 7.259 23.477 0.940 1.00 1.12 C ATOM 2324 O GLY C 156 8.031 24.060 0.182 1.00 1.47 O ATOM 0 H GLY C 156 6.306 22.053 3.146 1.00 1.07 H new ATOM 0 HA2 GLY C 156 6.410 24.432 2.654 1.00 1.18 H new ATOM 0 HA3 GLY C 156 8.159 24.329 2.682 1.00 1.18 H new ATOM 2328 N GLY C 157 6.395 22.567 0.524 1.00 1.06 N ATOM 2329 CA GLY C 157 6.311 22.209 -0.874 1.00 1.02 C ATOM 2330 C GLY C 157 4.879 22.153 -1.360 1.00 0.95 C ATOM 2331 O GLY C 157 4.317 21.074 -1.538 1.00 1.21 O ATOM 0 H GLY C 157 5.747 22.067 1.133 1.00 1.06 H new ATOM 0 HA2 GLY C 157 6.867 22.934 -1.468 1.00 1.02 H new ATOM 0 HA3 GLY C 157 6.785 21.240 -1.029 1.00 1.02 H new ATOM 2335 N SER C 158 4.279 23.315 -1.548 1.00 0.91 N ATOM 2336 CA SER C 158 2.905 23.403 -2.015 1.00 0.85 C ATOM 2337 C SER C 158 2.836 24.209 -3.309 1.00 0.93 C ATOM 2338 O SER C 158 3.680 25.075 -3.552 1.00 1.15 O ATOM 2339 CB SER C 158 2.038 24.052 -0.937 1.00 0.89 C ATOM 2340 OG SER C 158 2.287 23.465 0.331 1.00 0.93 O ATOM 0 H SER C 158 4.725 24.217 -1.383 1.00 0.91 H new ATOM 0 HA SER C 158 2.531 22.399 -2.216 1.00 0.85 H new ATOM 0 HB2 SER C 158 2.243 25.122 -0.894 1.00 0.89 H new ATOM 0 HB3 SER C 158 0.985 23.939 -1.194 1.00 0.89 H new ATOM 0 HG SER C 158 1.723 23.896 1.007 1.00 0.93 H new ATOM 2346 N GLY C 159 1.844 23.916 -4.139 1.00 0.84 N ATOM 2347 CA GLY C 159 1.690 24.624 -5.394 1.00 0.93 C ATOM 2348 C GLY C 159 0.263 25.074 -5.615 1.00 0.89 C ATOM 2349 O GLY C 159 -0.270 24.962 -6.719 1.00 0.98 O ATOM 0 H GLY C 159 1.141 23.198 -3.964 1.00 0.84 H new ATOM 0 HA2 GLY C 159 2.350 25.491 -5.405 1.00 0.93 H new ATOM 0 HA3 GLY C 159 1.999 23.978 -6.216 1.00 0.93 H new ATOM 2353 N GLY C 160 -0.357 25.581 -4.561 1.00 0.84 N ATOM 2354 CA GLY C 160 -1.729 26.038 -4.657 1.00 0.85 C ATOM 2355 C GLY C 160 -2.724 24.938 -4.352 1.00 0.82 C ATOM 2356 O GLY C 160 -2.418 23.749 -4.494 1.00 0.90 O ATOM 0 H GLY C 160 0.066 25.685 -3.638 1.00 0.84 H new ATOM 0 HA2 GLY C 160 -1.883 26.866 -3.965 1.00 0.85 H new ATOM 0 HA3 GLY C 160 -1.912 26.423 -5.660 1.00 0.85 H new ATOM 2360 N SER C 161 -3.914 25.328 -3.931 1.00 0.78 N ATOM 2361 CA SER C 161 -4.956 24.375 -3.604 1.00 0.77 C ATOM 2362 C SER C 161 -5.516 23.749 -4.877 1.00 0.71 C ATOM 2363 O SER C 161 -6.223 24.403 -5.644 1.00 0.83 O ATOM 2364 CB SER C 161 -6.059 25.073 -2.817 1.00 0.85 C ATOM 2365 OG SER C 161 -5.538 26.175 -2.091 1.00 1.04 O ATOM 0 H SER C 161 -4.182 26.304 -3.807 1.00 0.78 H new ATOM 0 HA SER C 161 -4.536 23.579 -2.990 1.00 0.77 H new ATOM 0 HB2 SER C 161 -6.837 25.416 -3.499 1.00 0.85 H new ATOM 0 HB3 SER C 161 -6.525 24.367 -2.130 1.00 0.85 H new ATOM 0 HG SER C 161 -6.262 26.611 -1.594 1.00 1.04 H new ATOM 2371 N GLY C 162 -5.163 22.494 -5.115 1.00 0.68 N ATOM 2372 CA GLY C 162 -5.630 21.808 -6.303 1.00 0.67 C ATOM 2373 C GLY C 162 -4.743 22.097 -7.495 1.00 0.70 C ATOM 2374 O GLY C 162 -4.993 21.615 -8.602 1.00 0.78 O ATOM 0 H GLY C 162 -4.562 21.938 -4.507 1.00 0.68 H new ATOM 0 HA2 GLY C 162 -5.655 20.734 -6.118 1.00 0.67 H new ATOM 0 HA3 GLY C 162 -6.652 22.117 -6.525 1.00 0.67 H new ATOM 2378 N GLY C 163 -3.703 22.883 -7.258 1.00 0.73 N ATOM 2379 CA GLY C 163 -2.780 23.239 -8.312 1.00 0.80 C ATOM 2380 C GLY C 163 -1.565 22.335 -8.339 1.00 0.79 C ATOM 2381 O GLY C 163 -1.317 21.585 -7.388 1.00 0.79 O ATOM 0 H GLY C 163 -3.482 23.283 -6.346 1.00 0.73 H new ATOM 0 HA2 GLY C 163 -3.291 23.186 -9.273 1.00 0.80 H new ATOM 0 HA3 GLY C 163 -2.459 24.272 -8.178 1.00 0.80 H new ATOM 2385 N SER C 164 -0.814 22.407 -9.431 1.00 0.87 N ATOM 2386 CA SER C 164 0.384 21.601 -9.610 1.00 0.90 C ATOM 2387 C SER C 164 1.392 21.856 -8.485 1.00 0.81 C ATOM 2388 O SER C 164 1.842 22.988 -8.285 1.00 0.93 O ATOM 2389 CB SER C 164 1.008 21.927 -10.967 1.00 1.13 C ATOM 2390 OG SER C 164 -0.001 22.206 -11.930 1.00 1.30 O ATOM 0 H SER C 164 -1.019 23.025 -10.216 1.00 0.87 H new ATOM 0 HA SER C 164 0.110 20.547 -9.576 1.00 0.90 H new ATOM 0 HB2 SER C 164 1.673 22.785 -10.870 1.00 1.13 H new ATOM 0 HB3 SER C 164 1.617 21.088 -11.304 1.00 1.13 H new ATOM 0 HG SER C 164 0.417 22.414 -12.791 1.00 1.30 H new ATOM 2396 N GLY C 165 1.726 20.807 -7.741 1.00 0.76 N ATOM 2397 CA GLY C 165 2.666 20.944 -6.648 1.00 0.78 C ATOM 2398 C GLY C 165 4.058 20.491 -7.029 1.00 0.81 C ATOM 2399 O GLY C 165 4.973 21.305 -7.143 1.00 1.14 O ATOM 0 H GLY C 165 1.361 19.864 -7.877 1.00 0.76 H new ATOM 0 HA2 GLY C 165 2.700 21.986 -6.329 1.00 0.78 H new ATOM 0 HA3 GLY C 165 2.317 20.361 -5.796 1.00 0.78 H new ATOM 2403 N GLY C 166 4.210 19.195 -7.243 1.00 0.87 N ATOM 2404 CA GLY C 166 5.500 18.648 -7.604 1.00 0.96 C ATOM 2405 C GLY C 166 5.376 17.275 -8.221 1.00 0.98 C ATOM 2406 O GLY C 166 4.265 16.821 -8.513 1.00 1.12 O ATOM 0 H GLY C 166 3.459 18.508 -7.173 1.00 0.87 H new ATOM 0 HA2 GLY C 166 5.995 19.318 -8.306 1.00 0.96 H new ATOM 0 HA3 GLY C 166 6.132 18.592 -6.718 1.00 0.96 H new ATOM 2410 N ASP C 167 6.506 16.611 -8.413 1.00 0.97 N ATOM 2411 CA ASP C 167 6.527 15.278 -9.008 1.00 1.02 C ATOM 2412 C ASP C 167 6.009 14.226 -8.032 1.00 0.87 C ATOM 2413 O ASP C 167 6.123 14.378 -6.811 1.00 1.07 O ATOM 2414 CB ASP C 167 7.948 14.904 -9.455 1.00 1.25 C ATOM 2415 CG ASP C 167 8.331 15.508 -10.792 1.00 1.16 C ATOM 2416 OD1 ASP C 167 8.843 16.647 -10.809 1.00 1.50 O ATOM 2417 OD2 ASP C 167 8.139 14.845 -11.834 1.00 1.44 O ATOM 0 H ASP C 167 7.426 16.974 -8.165 1.00 0.97 H new ATOM 0 HA ASP C 167 5.870 15.301 -9.878 1.00 1.02 H new ATOM 0 HB2 ASP C 167 8.659 15.234 -8.697 1.00 1.25 H new ATOM 0 HB3 ASP C 167 8.029 13.819 -9.517 1.00 1.25 H new ATOM 2422 N VAL C 168 5.441 13.163 -8.583 1.00 0.75 N ATOM 2423 CA VAL C 168 4.909 12.065 -7.793 1.00 0.60 C ATOM 2424 C VAL C 168 5.219 10.739 -8.493 1.00 0.65 C ATOM 2425 O VAL C 168 5.058 10.617 -9.712 1.00 0.78 O ATOM 2426 CB VAL C 168 3.383 12.212 -7.546 1.00 0.61 C ATOM 2427 CG1 VAL C 168 2.604 12.201 -8.857 1.00 0.82 C ATOM 2428 CG2 VAL C 168 2.878 11.124 -6.607 1.00 0.58 C ATOM 0 H VAL C 168 5.337 13.039 -9.590 1.00 0.75 H new ATOM 0 HA VAL C 168 5.390 12.084 -6.815 1.00 0.60 H new ATOM 0 HB VAL C 168 3.217 13.178 -7.070 1.00 0.61 H new ATOM 0 HG11 VAL C 168 1.539 12.306 -8.648 1.00 0.82 H new ATOM 0 HG12 VAL C 168 2.934 13.030 -9.483 1.00 0.82 H new ATOM 0 HG13 VAL C 168 2.781 11.260 -9.377 1.00 0.82 H new ATOM 0 HG21 VAL C 168 1.807 11.248 -6.449 1.00 0.58 H new ATOM 0 HG22 VAL C 168 3.069 10.146 -7.048 1.00 0.58 H new ATOM 0 HG23 VAL C 168 3.397 11.199 -5.651 1.00 0.58 H new ATOM 2438 N MET C 169 5.677 9.755 -7.736 1.00 0.56 N ATOM 2439 CA MET C 169 6.032 8.466 -8.312 1.00 0.60 C ATOM 2440 C MET C 169 5.199 7.334 -7.728 1.00 0.56 C ATOM 2441 O MET C 169 4.610 7.465 -6.654 1.00 0.53 O ATOM 2442 CB MET C 169 7.525 8.187 -8.102 1.00 0.64 C ATOM 2443 CG MET C 169 8.426 9.049 -8.974 1.00 1.02 C ATOM 2444 SD MET C 169 10.162 8.955 -8.491 1.00 1.10 S ATOM 2445 CE MET C 169 10.909 9.993 -9.746 1.00 1.55 C ATOM 0 H MET C 169 5.811 9.822 -6.727 1.00 0.56 H new ATOM 0 HA MET C 169 5.819 8.513 -9.380 1.00 0.60 H new ATOM 0 HB2 MET C 169 7.775 8.355 -7.055 1.00 0.64 H new ATOM 0 HB3 MET C 169 7.724 7.136 -8.312 1.00 0.64 H new ATOM 0 HG2 MET C 169 8.325 8.737 -10.013 1.00 1.02 H new ATOM 0 HG3 MET C 169 8.094 10.086 -8.919 1.00 1.02 H new ATOM 0 HE1 MET C 169 11.911 9.628 -9.970 1.00 1.55 H new ATOM 0 HE2 MET C 169 10.301 9.965 -10.651 1.00 1.55 H new ATOM 0 HE3 MET C 169 10.969 11.018 -9.381 1.00 1.55 H new ATOM 2455 N VAL C 170 5.150 6.226 -8.454 1.00 0.61 N ATOM 2456 CA VAL C 170 4.407 5.047 -8.033 1.00 0.60 C ATOM 2457 C VAL C 170 5.376 3.947 -7.615 1.00 0.63 C ATOM 2458 O VAL C 170 6.432 3.787 -8.228 1.00 0.73 O ATOM 2459 CB VAL C 170 3.488 4.535 -9.169 1.00 0.65 C ATOM 2460 CG1 VAL C 170 2.656 3.343 -8.717 1.00 0.65 C ATOM 2461 CG2 VAL C 170 2.585 5.652 -9.670 1.00 0.68 C ATOM 0 H VAL C 170 5.624 6.119 -9.351 1.00 0.61 H new ATOM 0 HA VAL C 170 3.781 5.322 -7.184 1.00 0.60 H new ATOM 0 HB VAL C 170 4.127 4.206 -9.989 1.00 0.65 H new ATOM 0 HG11 VAL C 170 2.022 3.009 -9.539 1.00 0.65 H new ATOM 0 HG12 VAL C 170 3.318 2.531 -8.416 1.00 0.65 H new ATOM 0 HG13 VAL C 170 2.031 3.634 -7.873 1.00 0.65 H new ATOM 0 HG21 VAL C 170 1.946 5.273 -10.468 1.00 0.68 H new ATOM 0 HG22 VAL C 170 1.965 6.014 -8.850 1.00 0.68 H new ATOM 0 HG23 VAL C 170 3.196 6.470 -10.051 1.00 0.68 H new ATOM 2471 N VAL C 171 5.034 3.210 -6.564 1.00 0.57 N ATOM 2472 CA VAL C 171 5.896 2.133 -6.091 1.00 0.62 C ATOM 2473 C VAL C 171 6.027 1.044 -7.152 1.00 0.77 C ATOM 2474 O VAL C 171 5.044 0.654 -7.786 1.00 0.89 O ATOM 2475 CB VAL C 171 5.383 1.502 -4.773 1.00 0.61 C ATOM 2476 CG1 VAL C 171 5.528 2.478 -3.615 1.00 1.03 C ATOM 2477 CG2 VAL C 171 3.937 1.043 -4.906 1.00 0.91 C ATOM 0 H VAL C 171 4.175 3.336 -6.028 1.00 0.57 H new ATOM 0 HA VAL C 171 6.871 2.579 -5.895 1.00 0.62 H new ATOM 0 HB VAL C 171 5.996 0.625 -4.565 1.00 0.61 H new ATOM 0 HG11 VAL C 171 5.161 2.013 -2.700 1.00 1.03 H new ATOM 0 HG12 VAL C 171 6.578 2.743 -3.492 1.00 1.03 H new ATOM 0 HG13 VAL C 171 4.948 3.378 -3.823 1.00 1.03 H new ATOM 0 HG21 VAL C 171 3.606 0.605 -3.964 1.00 0.91 H new ATOM 0 HG22 VAL C 171 3.305 1.897 -5.150 1.00 0.91 H new ATOM 0 HG23 VAL C 171 3.863 0.298 -5.699 1.00 0.91 H new ATOM 2487 N GLY C 172 7.250 0.582 -7.362 1.00 0.81 N ATOM 2488 CA GLY C 172 7.484 -0.459 -8.338 1.00 0.96 C ATOM 2489 C GLY C 172 7.455 -1.830 -7.703 1.00 0.99 C ATOM 2490 O GLY C 172 7.362 -1.948 -6.478 1.00 1.04 O ATOM 0 H GLY C 172 8.084 0.910 -6.874 1.00 0.81 H new ATOM 0 HA2 GLY C 172 6.727 -0.403 -9.120 1.00 0.96 H new ATOM 0 HA3 GLY C 172 8.450 -0.299 -8.817 1.00 0.96 H new ATOM 2494 N GLU C 173 7.535 -2.862 -8.525 1.00 1.04 N ATOM 2495 CA GLU C 173 7.522 -4.231 -8.029 1.00 1.10 C ATOM 2496 C GLU C 173 8.773 -4.511 -7.198 1.00 1.06 C ATOM 2497 O GLU C 173 9.837 -3.940 -7.453 1.00 1.05 O ATOM 2498 CB GLU C 173 7.406 -5.220 -9.194 1.00 1.25 C ATOM 2499 CG GLU C 173 8.517 -5.105 -10.225 1.00 1.53 C ATOM 2500 CD GLU C 173 8.087 -5.612 -11.584 1.00 1.63 C ATOM 2501 OE1 GLU C 173 7.518 -4.820 -12.366 1.00 1.72 O ATOM 2502 OE2 GLU C 173 8.302 -6.808 -11.872 1.00 1.96 O ATOM 0 H GLU C 173 7.610 -2.780 -9.539 1.00 1.04 H new ATOM 0 HA GLU C 173 6.652 -4.360 -7.385 1.00 1.10 H new ATOM 0 HB2 GLU C 173 7.400 -6.234 -8.795 1.00 1.25 H new ATOM 0 HB3 GLU C 173 6.448 -5.067 -9.691 1.00 1.25 H new ATOM 0 HG2 GLU C 173 8.827 -4.063 -10.309 1.00 1.53 H new ATOM 0 HG3 GLU C 173 9.385 -5.670 -9.886 1.00 1.53 H new ATOM 2509 N PRO C 174 8.649 -5.368 -6.177 1.00 1.09 N ATOM 2510 CA PRO C 174 9.766 -5.721 -5.299 1.00 1.08 C ATOM 2511 C PRO C 174 10.856 -6.500 -6.024 1.00 1.15 C ATOM 2512 O PRO C 174 10.583 -7.243 -6.971 1.00 1.34 O ATOM 2513 CB PRO C 174 9.119 -6.592 -4.217 1.00 1.15 C ATOM 2514 CG PRO C 174 7.883 -7.130 -4.849 1.00 1.30 C ATOM 2515 CD PRO C 174 7.405 -6.061 -5.791 1.00 1.17 C ATOM 0 HA PRO C 174 10.263 -4.833 -4.908 1.00 1.08 H new ATOM 0 HB2 PRO C 174 9.786 -7.396 -3.905 1.00 1.15 H new ATOM 0 HB3 PRO C 174 8.886 -6.008 -3.327 1.00 1.15 H new ATOM 0 HG2 PRO C 174 8.089 -8.058 -5.383 1.00 1.30 H new ATOM 0 HG3 PRO C 174 7.126 -7.356 -4.098 1.00 1.30 H new ATOM 0 HD2 PRO C 174 6.896 -6.486 -6.656 1.00 1.17 H new ATOM 0 HD3 PRO C 174 6.701 -5.384 -5.307 1.00 1.17 H new ATOM 2523 N THR C 175 12.086 -6.324 -5.579 1.00 1.04 N ATOM 2524 CA THR C 175 13.217 -7.006 -6.175 1.00 1.11 C ATOM 2525 C THR C 175 13.330 -8.432 -5.637 1.00 1.12 C ATOM 2526 O THR C 175 12.901 -8.722 -4.520 1.00 1.05 O ATOM 2527 CB THR C 175 14.518 -6.235 -5.898 1.00 1.07 C ATOM 2528 OG1 THR C 175 14.284 -5.248 -4.883 1.00 1.03 O ATOM 2529 CG2 THR C 175 15.028 -5.561 -7.161 1.00 1.30 C ATOM 0 H THR C 175 12.327 -5.710 -4.801 1.00 1.04 H new ATOM 0 HA THR C 175 13.058 -7.051 -7.252 1.00 1.11 H new ATOM 0 HB THR C 175 15.274 -6.942 -5.557 1.00 1.07 H new ATOM 0 HG1 THR C 175 14.395 -5.656 -3.999 1.00 1.03 H new ATOM 0 HG21 THR C 175 15.949 -5.022 -6.939 1.00 1.30 H new ATOM 0 HG22 THR C 175 15.224 -6.316 -7.923 1.00 1.30 H new ATOM 0 HG23 THR C 175 14.278 -4.861 -7.528 1.00 1.30 H new